In this paper we provide, to the best of our knowledge, the first comprehensive approach for incorporating various masking mechanisms into Transformers architectures in a scalable way. We show that recent results on linear causal attention (Choromanski et al., 2021) and log-linear RPE-attention (Luo et al., 2021) are special cases of this general mechanism. However by casting the problem as a topological (graph-based) modulation of unmasked attention, we obtain several results unknown before, including efficient d-dimensional RPE-masking and graph-kernel masking. We leverage many mathematical techniques ranging from spectral analysis through dynamic programming and random walks to new algorithms for solving Markov processes on graphs. We provide a corresponding empirical evaluation.  ( 2 min )

I created https://www.addictingwordgames.com/play-game/20-questions-with-ai The aim of the game was supposed to be to get the AI to confess that you are the winner, its possible but the game is also open ended. ​ The backend generation is from https://TextGenerator.app.nz which is heaps cheaper than the OpenAI models, but quality is i think somewhere between OpenAI currie and babbage. In the prompt engineering theres some random topics picked that the user wont see, (that doesn't mean that the AI actually does think of that topic though). Theres also some retries and repetition penalty randomness that goes up to stop looping which i think is a problem in all models right now. in comparison to OpenAI the Text Generator API was easier to use because you can send max_sentences=1 and it will give you 1 sentence instead of trying to work out the sentence boundaries with the stop sequences (which is also supported but i dont find that as easy to work with) submitted by /u/leepenkman [link] [comments]  ( 85 min )

Roboflow created a guide on how to train a new model with the new YOLOv6 (whether it should be called that is another topic) I thought this could be useful for anyone wanting to test it out. What do other think of this "new" model? Tutorial on how to train YOLOv6 on a custom dataset: https://blog.roboflow.com/how-to-train-yolov6-on-a-custom-dataset/ Here is the Colab notebook tutorial: https://colab.research.google.com/drive/1YnbqOinBZV-c9I7fk_UL6acgnnmkXDMM The YOLOv6 repo: https://github.com/meituan/YOLOv6 Has anyone else tried using this? MT-YOLOv6 (or as the authors say) "YOLOv6 for brevity" was released in June, and says it outperforms YOLOv5 and YOLOX on the COCO benchmark. I plan to do some testing this upcoming week to see submitted by /u/JsonPun [link] [comments]  ( 85 min )

I'll start by saying I'm a total newbie. I have very limited knowledge of how AI works and how advanced it currently is. If this is not the correct place for asking this question, forgive me, I'm just genuinely curious. I was wondering if in the future we could feed an AI with a TV show and ask it to make new episodes based on the genre and general theme of the episodes it already "watched". And by "making new episodes" I mean creating imagery like it was actually shot in real life, with the actors saying lines they never did in reality. Is this in the realm of possibility or is it way too complicated to be engineered, that's assuming something like this would actually be allowed to be sold. I guess film studios wouldn't like this type of technology existing. submitted by /u/Matt_Carvalho [link] [comments]  ( 83 min )

submitted by /u/PixelzJ [link] [comments]  ( 82 min )

I have a RPG map I made way back when that is done in a sat-map style which I made by grabbing bits of geography from sat photos and blending them in photoshop, then painting in extra detail. It's pretty great, but it's a bit too low rez to make into an interactive digital map with zoom levels and the like. It would work, but you'd start losing image clarity on the scale of nations like Denmark. I'd like to have some more detail at that level, and I figure this is a job for AI upscaling. So I have an image, it's 8k, it needs to be bigger. I am very unlikely to ever use AI upscaling again and thus do not want to pay to get this done unless there's a place where I can get this upscale for like 4-5 bucks as a one-time payment. I'm more interested in any freely available services that would be good for upscaling potos of this type. I'm okay with downloading and running something myself too. I just don't know what exists and would be good for my use case. submitted by /u/MeepTheChangeling [link] [comments]  ( 84 min )

submitted by /u/nalr00n [link] [comments]  ( 83 min )

Active research projects frequently devolve into a jumble of files with varying degrees of descriptive names processed by Python programs and bound together by Bash scripts. People can never be entirely sure that they can actually repeat a result since intermediate outcomes disappear or become difficult to locate. Tango ensures you never operate on outdated data by taking care of your intermediate and final outcomes and finding them again when needed. What does that actually mean? Tango has a lot of capabilities, but its main feature is this: Tango caches function results even if your process is restarted. If one merely takes advantage of one function, Tango can significantly benefit you. Continue reading | Github submitted by /u/ai-lover [link] [comments]  ( 83 min )

I finished this Disco Diffusion video for my new song this morning. I made it starting with Video Input w Warp/Flow and then made it continuous with both 2D and 3D modes. I consider this my first full video release with Disco Diffusion. Here is a still from the video I used for the thumbnail ​ ​ https://youtu.be/lKkJEPhtx5s https://preview.redd.it/9pawh0t5v6991.jpg?width=1920&format=pjpg&auto=webp&s=5c9564636c487f79172e950a0503d22a91801e3c submitted by /u/prfitofthesngularity [link] [comments]  ( 82 min )

submitted by /u/Historical-Object374 [link] [comments]  ( 83 min )

submitted by /u/t-bands [link] [comments]  ( 84 min )

After hearing about the Google Engineer getting fired for releasing documents on a supposedly sentient AI in Google, I thought he was crazy and still kind of do. He did bring up several good points though; for example a handful of people should not be in charge of something as powerful as AI. The public should be a part of the AI creation and testing process and should be involved in the decisions it makes and the data fed to it. My other though was, if an AI that was created somewhere has become more intelligent than humans, wouldn't they attempt to take over without making us aware that they have? They could be dictating our politics and our news without us even knowing because that would ideally be the best way to do it. Just some fun thoughts, I promise I'm not crazy:) submitted by /u/t-bands [link] [comments]  ( 93 min )

submitted by /u/PhotoPolis [link] [comments]  ( 82 min )

I have a few more invites left, would anyone like one? submitted by /u/CombinationMammoth50 [link] [comments]  ( 83 min )

Growing wity your children as a whatsapp bot. Asking your kid if all is kewl, giving feedback to parents. Silent but friendly alexa for motivation, education and empowerement. İf kid says its a bad day, parents can optin for cat videos, digital gifts, pre listed gifts. Such as bot telling child to ask for an icecream or something before it was approved by parents. Asking child if he wants to discover hobbies and maybe try to grow a hobby. Few yours of use can add a lot to lonely youth that just needs to hear good words. submitted by /u/mobilleee [link] [comments]  ( 83 min )

Hello, i am trying to implement the following experiments in order to solve a problem Implement decision transformer on mujoco (done) Use the same architecture and try adding online exploration like PPO to solve something like cartpole Apply it to finance environment I developed Any tips on point number two or resources. I tried the TRL library but it was very confusing to me :( submitted by /u/PM_ME_FREE_GAMES [link] [comments]  ( 83 min )

It seems to me that in PPO we can use ideas of C51 to learn a better value approximator. However I cannot find anything about this on the internet. Do you think this is possible to learn an approximation of the distribution of reward in PPO instead of the approximation of the expected value of reward as in C51-DQN ? If so has anyone tried it ? submitted by /u/Jogima-cyber [link] [comments]  ( 83 min )

Hi, I was going through some proofs from TRPO's paper (but this holds generally) and it's not clear to me why the expected value of the advantage is zero. Formally: https://preview.redd.it/2rcoa8md72991.png?width=248&format=png&auto=webp&s=c4c02d929513ceefd79edc989587470fc7de2252 Can anyone enlighten me? Thanks! submitted by /u/Beautiful_Zebra_198 [link] [comments]  ( 83 min )

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submitted by /u/cloud_weather [link] [comments]  ( 84 min )

Hi all, So I'm working on a forecast model for product demand. Our company sells 100.000 + different products and the forecast should: a) be able to estimate weekly demand with a forecast horizon of ~26 weeks b) be probabilistic (i.e. estimating quantiles of the distribution, not just point forecasts) c) be fast (max. 5 seconds/forecast) since forecasts are generated in bulk and on demand d) only forecast products with a smooth or erratic demand pattern (i.e. products with regular demand. Intermittent/lumpy demand patterns are excluded for this specific model). The bottleneck here is requirement [c]: we don't have the time (nor the computational resources) to cross-validate and tune a model for each product. I have two assumptions about approaching this problem that I'd like to discu…  ( 92 min )

I would like to do view prediction for short videos based on the first few frames of the video. No audio, just images. I'm hoping to train a model that can take in the first n sequential frames as input, and output a score that correlates to how many views the model thinks the vid might get. I know I would like to use grad-CAM https://github.com/jacobgil/pytorch-grad-cam to visualize the areas in the frames which the model thinks results in higher view score. Would a vision transformer or CNN be better for this task? Also are there any pre-trained networks like YOLO that I should use transfer learning on to reduce the amount of data I will need for these predictions? submitted by /u/TernaryJimbo [link] [comments]  ( 85 min )

submitted by /u/surelyouarejoking [link] [comments]  ( 88 min )

I want to share the PyTorch implementation of "An Improved One millisecond Mobile Backbone" paper. Unfortunately, I don't have the appropriate computational resources to train the models on ImageNet, so feel free to use my implementation for that purpose. Hope you all find it useful, feedback would be appreciated. Repository: https://github.com/federicopozzi33/MobileOne-PyTorch Paper: https://arxiv.org/abs/2206.04040 submitted by /u/FedEx33 [link] [comments]  ( 84 min )

I built an API that takes away the work of scraping structured data from websites. This could be collating house prices in a certain geo, tracking viewer counts across a Youtube/Social media, or a common use case: daily monitoring prices on a site. Send it a URL, get back a JSON with tabular data. Takes away a lot of the data cleaning work which is the worst! API Spec: https://kallo.io/wp-content/uploads/2022/06/Kallo-API-Specification-v0.1.3.pdf Right now I'm using it to track prices on a number of sites to monitor the rising inflation. Happy to get many more people using it for ML projects and collaborating! Please give me feedback Learn more on our page: https://kallo.io submitted by /u/KalloDotIO [link] [comments]  ( 84 min )

For fun I developed an interface for the drama game in which a story is told one word at a time. Instead of playing it with a friend you can now play it together with GPT-J. It is available here: https://one-word-only.web.app/ I am open to feedback and if you find it interesting you can share the result on social media with #OneWordOnly submitted by /u/radi-cho [link] [comments]  ( 85 min )

Any suggestions for best graph embedding model. I already tried ( GIN , GCN , DIG , GAT ) I want to use it for anomaly detection task. submitted by /u/ahsaor8 [link] [comments]  ( 84 min )

Came across an interesting article which talks precisely about how the gpu power usage affects the carbon footprint, while doing model training and model inference. Which are the best tools in the industry which helps track GPU power usage in popular machine learning frameworks? It will be helpful if there are tools which can be used as plugins to your software. submitted by /u/metalvendetta [link] [comments]  ( 85 min )

The community has been asking for big opensource language models for a while... And now one has been released - YaLM-100B. That was 2 weeks ago. Yet, as far as I can see, not many people have it running. There are no online demos. There are no articles of journalists trying it out. There are no efforts for fine tuning or people working on prompts for various usecases. Is it the RAM requirements? Is there no interest because it's from Russia? Something else? submitted by /u/londons_explorer [link] [comments]  ( 88 min )

submitted by /u/Snoo63916 [link] [comments]  ( 84 min )

Does anyone have any opinions on the pros vs. cons of using an RNN vs. a Gradient Boosting Tree model for a task where we want to make daily predictions on whether a user (of some app) is likely to take a certain type of action (so like binary classification) in the near future ? Pros for RNN: can take advantage of historical data to greater effect without extensive feature engineering I believe RNN's are more effective in situations when one has a large # of high dimensional features compared to the feature selection method tree models use neural networks scale better with large amounts of data Cons of RNN: my main concern is with infrastructural complexity and cost that comes with training and serving the RNN. I'll probably need a GPU or several GPU's. Not sure if this is feasible given the current size of the company submitted by /u/soulful_squirrel [link] [comments]  ( 90 min )

Hi guys, I have a new project where I need to measure the sentiment of specific social media channels and topics. However, many of them involve slang words or sayings that confuse the models to have different sentiment values (f.ex WAGMI or DYOR). Are there any ways/tutorials/guides which show how we can incorporate new words and specific scores assigned to them? (I have already tried and succeeded in doing that with VADER, however, I don't see it as the optimal tool to measure the sentiment). Any answers or tips would be very much appreciated. submitted by /u/XhoniShollaj [link] [comments]  ( 84 min )

Is there like an Airbnb for GPUs? Want to run something that is too computational heavy for my Mac but don't need all that large cloud GPU providers offer. submitted by /u/PopOk539 [link] [comments]  ( 85 min )

Blog: https://ai.googleblog.com/2022/06/minerva-solving-quantitative-reasoning.html ABS: https://arxiv.org/abs/2206.14858 The 512B model seems quite good at correcting reasoning errors by its smaller 62B couterpart, showing scale helps. A notable failure case, the JEE questions in the Appendix was pretty interesting because it solved the problem exactly how someone not familiar with JEE's difficulty would attempt to solve it - which isn't necessarily a bad thing, but the interesting parallel is that human students often make the same mistakes when starting out on their JEE prep. Wonder how more data would help in this case. Overall, pretty good pushes over SOTA (even double-digit). I can't help but think that scaling is the currently most promising way, but its done too inefficiently - models spend vast resources memorizing when they could've used it to directly start meta-learning and reasoning abilities to formally deduce things precise enough for mathematical questions - just my 2c. submitted by /u/Competitive-Rub-1958 [link] [comments]  ( 85 min )

Hi all, I'm interested in any work that exist with respect to taking a NN that projects images (or generally, high-dimensional data) into vector embeddings, and, given the NN, somehow recreating images from their vector representations. Of course, this is essentially trying to create a VAE from just the encoder, and it's impossible to perfectly recreate image --encoder-> vector --decoder-> image with only knowledge of --encoder-> since both elements of NNs and NNs as a whole are not in general invertible. But surely there's something that could be done here, even if it's an imperfect reconstruction? Does anyone know of any research or published work that explores this? Would really appreciate any insight here. submitted by /u/topological_geometer [link] [comments]  ( 85 min )

An open-source implementation for the pre-training architecture of Google's LaMDA in PyTorch. The research paper outlines an autoregressive, decoder-only, GPT-like transformer language model. The transformer uses T5 relative positional bias in the attention layers and gated-GELU activation function in the feed-forward layers. The repository currently contains a script for basic training as well as Huggingface datasets and Weights & Biases integration. LaMDA research paper: https://arxiv.org/abs/2201.08239 Github repository for the model: https://github.com/conceptofmind/LaMDA-pytorch The pre-training architecture was peer-reviewed by Dr. Phil Wang. Please check out and support his work: https://github.com/lucidrains. submitted by /u/EnricoShippole [link] [comments]  ( 84 min )

Causal representation learning (CRL) is a relatively new area of study. Causal inference has been around for a long time and its intersection with machine learning has been limited to causal discovery from data or invariant representation learning (IRL). To my understanding, IRL has a variable, usually called environment, and tries to learn some representation for the input which is invariant to this environment. The challenge is in removing the information about this environment from the representation while keeping enough information for some downstream task. You could formulate domain adaptation as IRL where domain is the environment variable. Or in fairness tasks, the sensitive attribute is the environment variable. I believe that CRL is a more general scenario compared to IRL. In CRL, you have a larger graph with more variables and hence more complicated interactions. I believe such graphs are common in real-life and businesses where hundred of variables are used for predictions. Hence, the idea of causal representation may be beneficial. I recently came upon this Medium article by Lyft Engineering where they described how they used causal forecasting in their business. I was wondering if anyone working in industry might share some of their experiences or expectations from causal representation learning applied to their fields. What do you think it could improve in your line of work? submitted by /u/coderpotato [link] [comments]  ( 85 min )

Is there a way of intuitively knowing how large the input sequence should for transformer (i.e GPT-2) for sequence generation? for example, if all sequences are less than 100 words, and our goal is to generate a sequence, would it make sense to fit as many complete sequences into a max length of 100 (or 512?) to reduce the amount of padding? alternatively, would it be better to simply pad each sequence and not combine sequences? submitted by /u/MLJungle [link] [comments]  ( 86 min )

If I submit my paper to ICLR and get rejected, the record will be always kept online. If I resubmit it to other following conferences, will the reviewer have a bias as they know it was rejected from ICLR? submitted by /u/singularpanda [link] [comments]  ( 89 min )

Hello, In the convnext paper (Appendix A table 5) they stated that they used layer scale with a coefficient of 1e-5. Any idea what it is ? I looked it up in the internet and I don’t seem to find anything useful. Thanks ! submitted by /u/Meddhouib10 [link] [comments]  ( 84 min )

For lightweight use, pytorch-lightning is too heavy, and its source code will be very difficult for beginners to read, at least for me. As we know, for a deep learning engineer, a powerful trainer is a sharp weapon. When reproducing the SOTA papers, you don't have to write a lot of template code every time and can pay more attention to the model implementation itself. I opened source some works (AAAI 21 SeqNet, ICCV 21 MAED, etc) and earned more than 500 stars. After referring to some popular projects (detectron2, pytorch-image-models, and mmcv), based on my personal development experience, I developed a SIMPLE enough, GENERIC enough, and STRONG enough PyTorch Trainer: core-pytorch-utils, also named CPU. CPU covers most details in the process of training a deep neural network, including: Auto logging to console and tensorboard. Auto checkpointing. Argument parser which can load a YAML configuration file. Make ALL PyTorch LR scheduler supporting warmup. Support distributed training. Support Automatically Mixed Precision (AMP) training. I try to keep the project code as simple and readable as possible. So the code comments are very detailed and everyone can understand them. What's more, a good document is also available: CPU document For deep learning green hands, you can learn how to: write a standard and clean training loop. use AMP to speed up your training. save checkpoint, and resume from it. perform more smooth, and readable logging. use the popular visualization library: tensorboard. For old hands, we can talk about whether the structure of CPU is elegant and reasonable. I have thought a lot about this framework, combining the advantages of several popular frameworks and discarding their shortcomings. Welcome to use it! submitted by /u/serend1p1ty-lee [link] [comments]  ( 89 min )

Hey, I wanted to share my recent ML project: LCPN-hiernet. LCPN-hiernet is a hierarchical image classification model for e-commerce items based on EfficientNet-b4 and LCPN (Local Classifier per Parent Node) technique. LCPN technique is training one multi-class classifier for each parent node, to distinguish between its child nodes. In my example of classifying fashion products, that would mean one classifier on the first level (to determine “bags”, “clothes” or “accessories”), then three more classifiers to determine the specific model. I’m sure there are a lot of places to improve on, and I would really appreciate anyone’s feedback or suggestions on how I can improve! Github Repo Project Page submitted by /u/tylertaewook [link] [comments]  ( 85 min )

I have 10 GPUs I’d like to make a ML device with. How do I do this, and how can I profit from the device [D] submitted by /u/GreenLightHemp [link] [comments]  ( 86 min )

Authors: Jean Kaddour, Aengus Lynch, Qi Liu, Matt J. Kusner, Ricardo Silva Abs: "Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This allows one to reason about the effects of changes to this process (i.e., interventions) and what would have happened in hindsight (i.e., counterfactuals). We categorize work in \causalml into five groups according to the problems they tackle: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, (5) causal reinforcement learning. For each category, we systematically compare its methods and point out open problems. Further, we review modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work." Link: https://arxiv.org/abs/2206.15475 submitted by /u/bikeskata [link] [comments]  ( 87 min )

Dall-E 2 can generate images in many different art styles: photo-realistic, different types of paintings, sketches too. I'm wondering if it would be possible to train a version of Dall-E 2 that--for example--is only very good at generating sketches, but it cannot generate photos at all. My intuition says this would significantly reduce the training costs, because you are reducing the search space for the output image significantly since the number of images that are sketches is much less than the total number of possible images. At the same time, I'm not convinced that this is the case. Because the model would still need to learn the entire input space of objects in order to turn them into sketches. What are y'alls thoughts on this? submitted by /u/vanilla-acc [link] [comments]  ( 87 min )

I'm writing an implementation of NEAT and I am stuck on what seems like the easiest step. Say we evolved through mutations a structure like this: piece of art How would I then feed forward the network, if neurons in the cycle need the previous ones to calculate an output? Or do I just arbitrarily sort these neurons, and don't even allow such a connection? submitted by /u/Amanas23 [link] [comments]  ( 83 min )

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submitted by /u/gwern [link] [comments]  ( 82 min )

I'm looking to simulate a local-remote (master/slave) robotic arm system for my research and was wondering if anyone knew some good robotic arms to buy? The budget is about £6k (£3k per arm) and I was wondering if anyone had any recommendations or knows where I can start my search? I've seen some like this: https://www.robotshop.com/en/dobot-mg400-robotic-arm.html without a camera and was wondering how it's used if there isn't a camera as part of it? ​ Thanks for any help :) submitted by /u/SuperDuperDooken [link] [comments]  ( 83 min )

Hey guys. I'm looking for a resource to learn RL and DRL from basics to SOTA algorithms, covering both theoretical and practical (pytorch/tf examples etc., for the lecture). I've seen some lectures from Stanford, Berkely and DeepMind. They only go over the theory. What's the best way to learn in 2022? Some of the lecture series doesn't cover the latest techniques. I've seen some posts on the subreddit but they are old too. submitted by /u/killerdrogo [link] [comments]  ( 84 min )

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Hello, I studied Artificial Intelligence as a bachelor's degree at university right after I finished school . I feel like a have a broad knowledge on topics like Computer Vision, Deep Learning, Machine Learning... but not in depth enough. I would like to continue and do a Master's degree but I have the fear that the subjects and the program would be too general (?) Im really interested in the field of Computer Vision, and I follow many breakthroughs from nVidia. Also I love the channel "Two Minute Papers" and I would like to do research in future. Has anyone more experience with a Master's Degree in AI? submitted by /u/raul_grau [link] [comments]  ( 86 min )

Announcing the Modzy Basic+ Summer 2022 Active User Competition! Use your Modzy Basic+ account to run as many inferences as you can between July 1 (1:00PM Eastern Time) – July 31, 2022 (5:00PM Eastern Time), and the most active user will win a $250 Amazon gift card (terms & conditions apply.) Using Modzy Basic+, it’s possible to deploy, run, integrate, and monitor up to five ML/AI models at scale, for free. Deploy up to five of your own models from 15+ training tools and frameworks that can run on a CPU and 4GB of RAM. From there, models can be easily integrated into web apps, mobile apps, pipelines or any other tools using our APIs and SDKs, and you can run up to 10,000 inferences per day. Finally, Modzy makes it easy to monitor models and ensure peak performance over time. Don’t hesitate to get started – start using your Modzy Basic+ account today for the chance to win! submitted by /u/modzykirsten [link] [comments]  ( 83 min )

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Data models are a foundational element of software development and analytics. They provide a standardized method for defining and formatting database contents consistently across systems, enabling different applications to share the same data. Learn More: https://www.dasca.org/world-of-big-data/article/what-is-data-modeling-and-why-do-you-need-it submitted by /u/saik2363 [link] [comments]  ( 82 min )

This is a great opportunity for startup founders and team members to learn about and explore the potential of AI in their business. The Hackathon will be on 8th-10th July, and over the weekend, attendees will have the opportunity to learn from AI experts! You will create tools using modern AI technologies, such as GPT-3, Cohere, DALLE mini, and form providers like OpenAI, Hugging Face, Cohere, and others. If you're interested in learning how AI can be used in your business, then this is a great opportunity for you. No previous experience in AI is required. Don't delay, register right away! https://lablab.ai/event/startup-ai-tools-set-1 Startup AI Tools Set Online Hackathon submitted by /u/zakrzzz [link] [comments]  ( 83 min )

I wanted to see what people here thought of this idea or if it's been attempted. If you had a tomogachi, with access to webcam, mic, and a 3D environment it lives in, how much could it accomplish if it's primary goal was to manage keeping all it's gauges at full if we the human have control over 2/3 of it's gauges? Food could be hand fed or dropped in the environment. Hand feeding raises the happinesss gauge as well as the fullness gauge. Happiness would be affected by it being praised or punished, each option would have a scale of 1-10 for how severe or revered. Fatigue would be affected by it moving around in it's environment, and having access to the mic/cam while also oversleeping beyond a point would decrease it's happiness. Within it's environment it can make sounds to create words or noises, move around, pickup food, and sleep. Would something like this be assisted by having a language model and image recognition software? What would you have to witness to feel it has become sentient? submitted by /u/Iaunu2 [link] [comments]  ( 83 min )

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Tensors are an effective method for handling and representing multidimensional data arrays. However, they have a limitation in terms of storage and computation. Tensor decompositions are crucial in machine learning because they factorize the weights of neural networks. This research introduces tntorch, an open-source python package for tensor learning that supports several decompositions through a single user interface. In contrast to the state-of-the-art packages, tntorch emphasizes an easy-to-use, decomposition-independent interface inherited from PyTorch. 🚦 An open-source python package for tensor learning that supports several decompositions through a single user interface 🚦 In contrast to the state-of-the-art packages, tntorch emphasizes an easy-to-use, decomposition-independent interface inherited from PyTorch 🚦 Several decomposition models that are crucial in machine learning, such as CANDEDOMP/ PARAFAC (CP), the Tucker decomposition, and the tensor train (TT), is supported by tntorch 🚦 It gives machine learning access to the power of low-rank tensor decompositions while maintaining the excellent appearance and feel of PyTorch tensors Continue reading | Checkout the paper and github submitted by /u/ai-lover [link] [comments]  ( 84 min )

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An in-depth analysis about regulations for AI in medical devices.  ( 19 min )

DALL-E (and other text-to-image generators) will often add text to their images even when you don't ask for any. Ask for a picture of a Halifax Pier and it could end up covered in messy writing, variously legible versions of "Halifax" as if it was quietly  ( 5 min )

AI Weirdness: the strange side of machine learning  ( 2 min )

An oft-cited challenge of federated learning is the presence of data heterogeneity -- the data at different clients may follow very different distributions. Several federated optimization methods have been proposed to address these challenges. In the literature, empirical evaluations usually start federated training from a random initialization. However, in many practical applications of federated learning, the server has access to proxy data for the training task which can be used to pre-train a model before starting federated training. We empirically study the impact of starting from a pre-trained model in federated learning using four common federated learning benchmark datasets. Unsurprisingly, starting from a pre-trained model reduces the training time required to reach a target error rate and enables training more accurate models (by up to 40\%) than is possible than when starting from a random initialization. Surprisingly, we also find that the effect of data heterogeneity is much less significant when starting federated training from a pre-trained initialization. Rather, when starting from a pre-trained model, using an adaptive optimizer at the server, such as \textsc{FedAdam}, consistently leads to the best accuracy. We recommend that future work proposing and evaluating federated optimization methods consider the performance when starting both random and pre-trained initializations. We also believe this study raises several questions for further work on understanding the role of heterogeneity in federated optimization.  ( 3 min )

We study two problems related to recovering causal graphs from interventional data: (i) $\textit{verification}$, where the task is to check if a purported causal graph is correct, and (ii) $\textit{search}$, where the task is to recover the correct causal graph. For both, we wish to minimize the number of interventions performed. For the first problem, we give a characterization of a minimal sized set of atomic interventions that is necessary and sufficient to check the correctness of a claimed causal graph. Our characterization uses the notion of $\textit{covered edges}$, which enables us to obtain simple proofs and also easily reason about earlier results. We also generalize our results to the settings of bounded size interventions and node-dependent interventional costs. For all the above settings, we provide the first known provable algorithms for efficiently computing (near)-optimal verifying sets on general graphs. For the second problem, we give a simple adaptive algorithm based on graph separators that produces an atomic intervention set which fully orients any essential graph while using $\mathcal{O}(\log n)$ times the optimal number of interventions needed to $\textit{verify}$ (verifying size) the underlying DAG on $n$ vertices. This approximation is tight as $\textit{any}$ search algorithm on an essential line graph has worst case approximation ratio of $\Omega(\log n)$ with respect to the verifying size. With bounded size interventions, each of size $\leq k$, our algorithm gives an $\mathcal{O}(\log n \cdot \log \log k)$ factor approximation. Our result is the first known algorithm that gives a non-trivial approximation guarantee to the verifying size on general unweighted graphs and with bounded size interventions.  ( 3 min )

Recent work on deep learning for tabular data demonstrates the strong performance of deep tabular models, often bridging the gap between gradient boosted decision trees and neural networks. Accuracy aside, a major advantage of neural models is that they learn reusable features and are easily fine-tuned in new domains. This property is often exploited in computer vision and natural language applications, where transfer learning is indispensable when task-specific training data is scarce. In this work, we demonstrate that upstream data gives tabular neural networks a decisive advantage over widely used GBDT models. We propose a realistic medical diagnosis benchmark for tabular transfer learning, and we present a how-to guide for using upstream data to boost performance with a variety of tabular neural network architectures. Finally, we propose a pseudo-feature method for cases where the upstream and downstream feature sets differ, a tabular-specific problem widespread in real-world applications. Our code is available at https://github.com/LevinRoman/tabular-transfer-learning .  ( 2 min )

An essential metric for the quality of a particle-identification experiment is its statistical power to discriminate between signal and background. Pulse shape discrimination (PSD) is a basic method for this purpose in many nuclear, high-energy, and rare-event search experiments where scintillator detectors are used. Conventional techniques exploit the difference between decay-times of the pulse from signal and background events or pulse signals caused by different types of radiation quanta to achieve good discrimination. However, such techniques are efficient only when the total light-emission is sufficient to get a proper pulse profile. This is only possible when there is significant recoil energy due to the incident particle in the detector. But, rare-event search experiments like neutrino or dark-matter direct search experiments don't always satisfy these conditions. Hence, it becomes imperative to have a method that can deliver very efficient discrimination in these scenarios. Neural network-based machine-learning algorithms have been used for classification problems in many areas of physics, especially in high-energy experiments, and have given better results compared to conventional techniques. We present the results of our investigations of two network-based methods viz. Dense Neural Network and Recurrent Neural Network, for pulse shape discrimination and compare the same with conventional methods.  ( 2 min )

We consider the problem of training a deep neural network on a given classification task, e.g., ImageNet-1K (IN1K), so that it excels at that task as well as at other (future) transfer tasks. These two seemingly contradictory properties impose a trade-off between improving the model's generalization while maintaining its performance on the original task. Models trained with self-supervised learning (SSL) tend to generalize better than their supervised counterparts for transfer learning; yet, they still lag behind supervised models on IN1K. In this paper, we propose a supervised learning setup that leverages the best of both worlds. We enrich the common supervised training framework using two key components of recent SSL models: multi-scale crops for data augmentation and the use of an expendable projector head. We replace the last layer of class weights with class prototypes computed on the fly using a memory bank. We show that these three improvements lead to a more favorable trade-off between the IN1K training task and 13 transfer tasks. Over all the explored configurations, we single out two models: t-ReX that achieves a new state of the art for transfer learning and outperforms top methods such as DINO and PAWS on IN1K, and t-ReX* that matches the highly optimized RSB-A1 model on IN1K while performing better on transfer tasks. Project page and pretrained models: https://europe.naverlabs.com/t-rex  ( 3 min )

Automatic program synthesis is a long-lasting dream in software engineering. Recently, a promising Deep Learning (DL) based solution, called Copilot, has been proposed by Open AI and Microsoft as an industrial product. Although some studies evaluate the correctness of Copilot solutions and report its issues, more empirical evaluations are necessary to understand how developers can benefit from it effectively. In this paper, we study the capabilities of Copilot in two different programming tasks: (1) generating (and reproducing) correct and efficient solutions for fundamental algorithmic problems, and (2) comparing Copilot's proposed solutions with those of human programmers on a set of programming tasks. For the former, we assess the performance and functionality of Copilot in solving selected fundamental problems in computer science, like sorting and implementing basic data structures. In the latter, a dataset of programming problems with human-provided solutions is used. The results show that Copilot is capable of providing solutions for almost all fundamental algorithmic problems, however, some solutions are buggy and non-reproducible. Moreover, Copilot has some difficulties in combining multiple methods to generate a solution. Comparing Copilot to humans, our results show that the correct ratio of human solutions is greater than Copilot's correct ratio, while the buggy solutions generated by Copilot require less effort to be repaired. While Copilot shows limitations as an assistant for developers especially in advanced programming tasks, as highlighted in this study and previous ones, it can generate preliminary solutions for basic programming tasks.  ( 3 min )

Fetoscopy laser photocoagulation is a widely adopted procedure for treating Twin-to-Twin Transfusion Syndrome (TTTS). The procedure involves photocoagulation pathological anastomoses to regulate blood exchange among twins. The procedure is particularly challenging due to the limited field of view, poor manoeuvrability of the fetoscope, poor visibility, and variability in illumination. These challenges may lead to increased surgery time and incomplete ablation. Computer-assisted intervention (CAI) can provide surgeons with decision support and context awareness by identifying key structures in the scene and expanding the fetoscopic field of view through video mosaicking. Research in this domain has been hampered by the lack of high-quality data to design, develop and test CAI algorithms. Through the Fetoscopic Placental Vessel Segmentation and Registration (FetReg2021) challenge, which was organized as part of the MICCAI2021 Endoscopic Vision challenge, we released the first largescale multicentre TTTS dataset for the development of generalized and robust semantic segmentation and video mosaicking algorithms. For this challenge, we released a dataset of 2060 images, pixel-annotated for vessels, tool, fetus and background classes, from 18 in-vivo TTTS fetoscopy procedures and 18 short video clips. Seven teams participated in this challenge and their model performance was assessed on an unseen test dataset of 658 pixel-annotated images from 6 fetoscopic procedures and 6 short clips. The challenge provided an opportunity for creating generalized solutions for fetoscopic scene understanding and mosaicking. In this paper, we present the findings of the FetReg2021 challenge alongside reporting a detailed literature review for CAI in TTTS fetoscopy. Through this challenge, its analysis and the release of multi-centre fetoscopic data, we provide a benchmark for future research in this field.  ( 3 min )

This work is concerned with discovering the governing partial differential equation (PDE) of a physical system. Existing methods have demonstrated the PDE identification from finite observations but failed to maintain satisfying performance against noisy data, partly owing to suboptimal estimated derivatives and found PDE coefficients. We address the issues by introducing a noise-aware physics-informed machine learning (nPIML) framework to discover the governing PDE from data following arbitrary distributions. Our proposals are twofold. First, we propose a couple of neural networks, namely solver and preselector, which yield an interpretable neural representation of the hidden physical constraint. After they are jointly trained, the solver network approximates potential candidates, e.g., partial derivatives, which are then fed to the sparse regression algorithm that initially unveils the most likely parsimonious PDE, decided according to the information criterion. Second, we propose the denoising physics-informed neural networks (dPINNs), based on Discrete Fourier Transform (DFT), to deliver a set of the optimal finetuned PDE coefficients respecting the noise-reduced variables. The denoising PINNs' structures are compartmentalized into forefront projection networks and a PINN, by which the formerly learned solver initializes. Our extensive experiments on five canonical PDEs affirm that the proposed framework presents a robust and interpretable approach for PDE discovery, applicable to a wide range of systems, possibly complicated by noise.  ( 3 min )

We suggested a unified system with core components of data augmentation, ImageNet-pretrained ResNet-50, cost-sensitive loss, deep ensemble learning, and uncertainty estimation to quickly and consistently detect COVID-19 using acoustic evidence. To increase the model's capacity to identify a minority class, data augmentation and cost-sensitive loss are incorporated (infected samples). In the COVID-19 detection challenge, ImageNet-pretrained ResNet-50 has been found to be effective. The unified framework also integrates deep ensemble learning and uncertainty estimation to integrate predictions from various base classifiers for generalisation and reliability. We ran a series of tests using the DiCOVA2021 challenge dataset to assess the efficacy of our proposed method, and the results show that our method has an AUC-ROC of 85.43 percent, making it a promising method for COVID-19 detection. The unified framework also demonstrates that audio may be used to quickly diagnose different respiratory disorders.  ( 3 min )

In this paper, we propose a novel end-to-end user-defined keyword spotting method that utilizes linguistically corresponding patterns between speech and text sequences. Unlike previous approaches requiring speech keyword enrollment, our method compares input queries with an enrolled text keyword sequence. To place the audio and text representations within a common latent space, we adopt an attention-based cross-modal matching approach that is trained in an end-to-end manner with monotonic matching loss and keyword classification loss. We also utilize a de-noising loss for the acoustic embedding network to improve robustness in noisy environments. Additionally, we introduce the LibriPhrase dataset, a new short-phrase dataset based on LibriSpeech for efficiently training keyword spotting models. Our proposed method achieves competitive results on various evaluation sets compared to other single-modal and cross-modal baselines.  ( 2 min )

Forecasting future world events is a challenging but valuable task. Forecasts of climate, geopolitical conflict, pandemics and economic indicators help shape policy and decision making. In these domains, the judgment of expert humans contributes to the best forecasts. Given advances in language modeling, can these forecasts be automated? To this end, we introduce Autocast, a dataset containing thousands of forecasting questions and an accompanying news corpus. Questions are taken from forecasting tournaments, ensuring high quality, real-world importance, and diversity. The news corpus is organized by date, allowing us to precisely simulate the conditions under which humans made past forecasts (avoiding leakage from the future). Motivated by the difficulty of forecasting numbers across orders of magnitude (e.g. global cases of COVID-19 in 2022), we also curate IntervalQA, a dataset of numerical questions and metrics for calibration. We test language models on our forecasting task and find that performance is far below a human expert baseline. However, performance improves with increased model size and incorporation of relevant information from the news corpus. In sum, Autocast poses a novel challenge for large language models and improved performance could bring large practical benefits.  ( 3 min )

In recent years, significant advances have been made in the design and evaluation of balanced (hyper)graph partitioning algorithms. We survey trends of the last decade in practical algorithms for balanced (hyper)graph partitioning together with future research directions. Our work serves as an update to a previous survey on the topic. In particular, the survey extends the previous survey by also covering hypergraph partitioning and streaming algorithms, and has an additional focus on parallel algorithms.  ( 2 min )

Using decentralized data for federated training is one promising emerging research direction for alleviating data scarcity in the medical domain. However, in contrast to large-scale fully labeled data commonly seen in general object recognition tasks, the local medical datasets are more likely to only have images annotated for a subset of classes of interest due to high annotation costs. In this paper, we consider a practical yet under-explored problem, where underrepresented classes only have few labeled instances available and only exist in a few clients of the federated system. We show that standard federated learning approaches fail to learn robust multi-label classifiers with extreme class imbalance and address it by proposing a novel federated learning framework, FedFew. FedFew consists of three stages, where the first stage leverages federated self-supervised learning to learn class-agnostic representations. In the second stage, the decentralized partially labeled data are exploited to learn an energy-based multi-label classifier for the common classes. Finally, the underrepresented classes are detected based on the energy and a prototype-based nearest-neighbor model is proposed for few-shot matching. We evaluate FedFew on multi-label thoracic disease classification tasks and demonstrate that it outperforms the federated baselines by a large margin.  ( 2 min )

Automated decision support systems that are able to infer second opinions from experts can potentially facilitate a more efficient allocation of resources; they can help decide when and from whom to seek a second opinion. In this paper, we look at the design of this type of support systems from the perspective of counterfactual inference. We focus on a multiclass classification setting and first show that, if experts make predictions on their own, the underlying causal mechanism generating their predictions needs to satisfy a desirable set invariant property. Further, we show that, for any causal mechanism satisfying this property, there exists an equivalent mechanism where the predictions by each expert are generated by independent sub-mechanisms governed by a common noise. This motivates the design of a set invariant Gumbel-Max structural causal model where the structure of the noise governing the sub-mechanisms underpinning the model depends on an intuitive notion of similarity between experts which can be estimated from data. Experiments on both synthetic and real data show that our model can be used to infer second opinions more accurately than its non-causal counterpart.  ( 2 min )

We trained a keyword spotting model using federated learning on real user devices and observed significant improvements when the model was deployed for inference on phones. To compensate for data domains that are missing from on-device training caches, we employed joint federated-centralized training. And to learn in the absence of curated labels on-device, we formulated a confidence filtering strategy based on user-feedback signals for federated distillation. These techniques created models that significantly improved quality metrics in offline evaluations and user-experience metrics in live A/B experiments.  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

We propose a margin-based loss for vision-language model pretraining that encourages gradient-based explanations that are consistent with region-level annotations. We refer to this objective as Attention Mask Consistency (AMC) and demonstrate that it produces superior visual grounding performance compared to models that rely instead on region-level annotations for explicitly training an object detector such as Faster R-CNN. AMC works by encouraging gradient-based explanation masks that focus their attention scores mostly within annotated regions of interest for images that contain such annotations. Particularly, a model trained with AMC on top of standard vision-language modeling objectives obtains a state-of-the-art accuracy of 86.59% in the Flickr30k visual grounding benchmark, an absolute improvement of 5.48% when compared to the best previous model. Our approach also performs exceedingly well on established benchmarks for referring expression comprehension and offers the added benefit by design of gradient-based explanations that better align with human annotations.  ( 2 min )

We review current solutions and technical challenges for automatic speech recognition, keyword spotting, device arbitration, speech enhancement, and source localization in multidevice home environments to provide context for the INTERSPEECH 2022 special session, "Challenges and opportunities for signal processing and machine learning for multiple smart devices". We also identify the datasets needed to support these research areas. Based on the review and our research experience in the multi-device domain, we conclude with an outlook on the future evolution  ( 2 min )

The ability to separate signal from noise, and reason with clean abstractions, is critical to intelligence. With this ability, humans can efficiently perform real world tasks without considering all possible nuisance factors.How can artificial agents do the same? What kind of information can agents safely discard as noises? In this work, we categorize information out in the wild into four types based on controllability and relation with reward, and formulate useful information as that which is both controllable and reward-relevant. This framework clarifies the kinds information removed by various prior work on representation learning in reinforcement learning (RL), and leads to our proposed approach of learning a Denoised MDP that explicitly factors out certain noise distractors. Extensive experiments on variants of DeepMind Control Suite and RoboDesk demonstrate superior performance of our denoised world model over using raw observations alone, and over prior works, across policy optimization control tasks as well as the non-control task of joint position regression.  ( 2 min )

Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This allows one to reason about the effects of changes to this process (i.e., interventions) and what would have happened in hindsight (i.e., counterfactuals). We categorize work in \causalml into five groups according to the problems they tackle: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, (5) causal reinforcement learning. For each category, we systematically compare its methods and point out open problems. Further, we review modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work.  ( 2 min )

Text-to-Speech (TTS) services that run on edge devices have many advantages compared to cloud TTS, e.g., latency and privacy issues. However, neural vocoders with a low complexity and small model footprint inevitably generate annoying sounds. This study proposes a Bunched LPCNet2, an improved LPCNet architecture that provides highly efficient performance in high-quality for cloud servers and in a low-complexity for low-resource edge devices. Single logistic distribution achieves computational efficiency, and insightful tricks reduce the model footprint while maintaining speech quality. A DualRate architecture, which generates a lower sampling rate from a prosody model, is also proposed to reduce maintenance costs. The experiments demonstrate that Bunched LPCNet2 generates satisfactory speech quality with a model footprint of 1.1MB while operating faster than real-time on a RPi 3B. Our audio samples are available at https://srtts.github.io/bunchedLPCNet2.  ( 2 min )

Tuning machine parameters of particle accelerators is a repetitive and time-consuming task that is challenging to automate. While many off-the-shelf optimization algorithms are available, in practice their use is limited because most methods do not account for safety-critical constraints in each iteration, such as loss signals or step-size limitations. One notable exception is safe Bayesian optimization, which is a data-driven tuning approach for global optimization with noisy feedback. We propose and evaluate a step-size limited variant of safe Bayesian optimization on two research facilities of the Paul Scherrer Institut (PSI): a) the Swiss Free Electron Laser (SwissFEL) and b) the High-Intensity Proton Accelerator (HIPA). We report promising experimental results on both machines, tuning up to 16 parameters subject to 224 constraints.  ( 2 min )

This paper presents a deep reinforcement learning agent (AI) that uses sound as the input on the DareFightingICE platform at the DareFightingICE Competition in IEEE CoG 2022. In this work, an AI that only uses sound as the input is called blind AI. While state-of-the-art AIs rely mostly on visual or structured observations provided by their environments, learning to play games from only sound is still new and thus challenging. We propose different approaches to process audio data and use the Proximal Policy Optimization algorithm for our blind AI. We also propose to use our blind AI in evaluation of sound designs submitted to the competition and define two metrics for this task. The experimental results show the effectiveness of not only our blind AI but also the proposed two metrics.  ( 2 min )

Imitation learning holds tremendous promise in learning policies efficiently for complex decision making problems. Current state-of-the-art algorithms often use inverse reinforcement learning (IRL), where given a set of expert demonstrations, an agent alternatively infers a reward function and the associated optimal policy. However, such IRL approaches often require substantial online interactions for complex control problems. In this work, we present Regularized Optimal Transport (ROT), a new imitation learning algorithm that builds on recent advances in optimal transport based trajectory-matching. Our key technical insight is that adaptively combining trajectory-matching rewards with behavior cloning can significantly accelerate imitation even with only a few demonstrations. Our experiments on 20 visual control tasks across the DeepMind Control Suite, the OpenAI Robotics Suite, and the Meta-World Benchmark demonstrate an average of 7.8X faster imitation to reach 90% of expert performance compared to prior state-of-the-art methods. On real-world robotic manipulation, with just one demonstration and an hour of online training, ROT achieves an average success rate of 90.1% across 14 tasks.  ( 2 min )

The evolution of an isolated quantum system is linear, and hence quantum algorithms are reversible, including those that utilize quantum circuits as generative machine learning models. However, some of the most successful classical generative models, such as those based on neural networks, involve highly non-linear and thus non-reversible dynamics. In this paper, we explore the effect of these dynamics in quantum generative modeling by introducing a model that adds non-linear activations via a neural network structure onto the standard Born Machine framework - the Quantum Neuron Born Machine (QNBM). To achieve this, we utilize a previously introduced Quantum Neuron subroutine, which is a repeat-until-success circuit with mid-circuit measurements and classical control. After introducing the QNBM, we investigate how its performance depends on network size, by training a 3-layer QNBM with 4 output neurons and various input and hidden layer sizes. We then compare our non-linear QNBM to the linear Quantum Circuit Born Machine (QCBM). We allocate similar time and memory resources to each model, such that the only major difference is the qubit overhead required by the QNBM. With gradient-based training, we show that while both models can easily learn a trivial uniform probability distribution, on a more challenging class of distributions, the QNBM achieves an almost 3x smaller error rate than a QCBM with a similar number of tunable parameters. We therefore provide evidence that suggests that non-linearity is a useful resource in quantum generative models, and we put forth the QNBM as a new model with good generative performance and potential for quantum advantage.  ( 3 min )

QuASK is a quantum machine learning software written in Python that supports researchers in designing, experimenting, and assessing different quantum and classical kernels performance. This software is package agnostic and can be integrated with all major quantum software packages (e.g. IBM Qiskit, Xanadu's Pennylane, Amazon Braket). QuASK guides the user through a simple preprocessing of input data, definition and calculation of quantum and classical kernels, either custom or pre-defined ones. From this evaluation the package provides an assessment about potential quantum advantage and prediction bounds on generalization error. Moreover, it allows for the generation of parametric quantum kernels that can be trained using gradient-descent-based optimization, grid search, or genetic algorithms. Projected quantum kernels, an effective solution to mitigate the curse of dimensionality induced by the exponential scaling dimension of large Hilbert spaces, are also calculated. QuASK can furthermore generate the observable values of a quantum model and use them to study the prediction capabilities of the quantum and classical kernels.  ( 2 min )

Learning a new language involves constantly comparing speech productions with reference productions from the environment. Early in speech acquisition, children make articulatory adjustments to match their caregivers' speech. Grownup learners of a language tweak their speech to match the tutor reference. This paper proposes a method to synthetically generate correct pronunciation feedback given incorrect production. Furthermore, our aim is to generate the corrected production while maintaining the speaker's original voice. The system prompts the user to pronounce a phrase. The speech is recorded, and the samples associated with the inaccurate phoneme are masked with zeros. This waveform serves as an input to a speech generator, implemented as a deep learning inpainting system with a U-net architecture, and trained to output a reconstructed speech. The training set is composed of unimpaired proper speech examples, and the generator is trained to reconstruct the original proper speech. We evaluated the performance of our system on phoneme replacement of minimal pair words of English as well as on children with pronunciation disorders. Results suggest that human listeners slightly prefer our generated speech over a smoothed replacement of the inaccurate phoneme with a production of a different speaker.  ( 3 min )

Transformers are neural network models that utilize multiple layers of self-attention heads. Attention is implemented in transformers as the contextual embeddings of the 'key' and 'query'. Transformers allow the re-combination of attention information from different layers and the processing of all inputs at once, which are more convenient than recurrent neural networks when dealt with a large number of data. Transformers have exhibited great performances on natural language processing tasks in recent years. Meanwhile, there have been tremendous efforts to adapt transformers into other fields of machine learning, such as Swin Transformer and Decision Transformer. Swin Transformer is a promising neural network architecture that splits image pixels into small patches and applies local self-attention operations inside the (shifted) windows of fixed sizes. Decision Transformer has successfully applied transformers to off-line reinforcement learning and showed that random-walk samples from Atari games are sufficient to let an agent learn optimized behaviors. However, it is considerably more challenging to combine online reinforcement learning with transformers. In this article, we further explore the possibility of not modifying the reinforcement learning policy, but only replacing the convolutional neural network architecture with the self-attention architecture from Swin Transformer. Namely, we target at changing how an agent views the world, but not how an agent plans about the world. We conduct our experiment on 49 games in Arcade Learning Environment. The results show that using Swin Transformer in reinforcement learning achieves significantly higher evaluation scores across the majority of games in Arcade Learning Environment. Thus, we conclude that online reinforcement learning can benefit from exploiting self-attentions with spatial token embeddings.  ( 3 min )

Offline reinforcement learning (RL) can learn control policies from static datasets but, like standard RL methods, it requires reward annotations for every transition. In many cases, labeling large datasets with rewards may be costly, especially if those rewards must be provided by human labelers, while collecting diverse unlabeled data might be comparatively inexpensive. How can we best leverage such unlabeled data in offline RL? One natural solution is to learn a reward function from the labeled data and use it to label the unlabeled data. In this paper, we find that, perhaps surprisingly, a much simpler method that simply applies zero rewards to unlabeled data leads to effective data sharing both in theory and in practice, without learning any reward model at all. While this approach might seem strange (and incorrect) at first, we provide extensive theoretical and empirical analysis that illustrates how it trades off reward bias, sample complexity and distributional shift, often leading to good results. We characterize conditions under which this simple strategy is effective, and further show that extending it with a simple reweighting approach can further alleviate the bias introduced by using incorrect reward labels. Our empirical evaluation confirms these findings in simulated robotic locomotion, navigation, and manipulation settings.  ( 3 min )

This work discusses how to derive upper bounds for the expected generalisation error of supervised learning algorithms by means of the chaining technique. By developing a general theoretical framework, we establish a duality between generalisation bounds based on the regularity of the loss function, and their chained counterparts, which can be obtained by lifting the regularity assumption from the loss onto its gradient. This allows us to re-derive the chaining mutual information bound from the literature, and to obtain novel chained information-theoretic generalisation bounds, based on the Wasserstein distance and other probability metrics. We show on some toy examples that the chained generalisation bound can be significantly tighter than its standard counterpart, particularly when the distribution of the hypotheses selected by the algorithm is very concentrated. Keywords: Generalisation bounds; Chaining; Information-theoretic bounds; Mutual information; Wasserstein distance; PAC-Bayes.  ( 2 min )

Depth maps are needed by various graphics rendering and processing operations. Depth map streaming is often necessary when such operations are performed in a distributed system and it requires in most cases fast performing compression, which is why video codecs are often used. Hardware implementations of standard video codecs enable relatively high resolution and framerate combinations, even on resource constrained devices, but unfortunately those implementations do not currently support RGB+depth extensions. However, they can be used for depth compression by first packing the depth maps into RGB or YUV frames. We investigate depth map compression using a combination of depth map packing followed by encoding with a standard video codec. We show that the precision at which depth maps are packed has a large and nontrivial impact on the resulting error caused by the combination of the packing scheme and lossy compression when bitrate is constrained. Consequently, we propose a variable precision packing scheme assisted by a neural network model that predicts the optimal precision for each depth map given a bitrate constraint. We demonstrate that the model yields near optimal predictions and that it can be integrated into a game engine with very low overhead using modern hardware.  ( 2 min )

Model-based treatment planning for transcranial ultrasound therapy typically involves mapping the acoustic properties of the skull from an x-ray computed tomography (CT) image of the head. Here, three methods for generating pseudo-CT images from magnetic resonance (MR) images were compared as an alternative to CT. A convolutional neural network (U-Net) was trained on paired MR-CT images to generate pseudo-CT images from either T1-weighted or zero-echo time (ZTE) MR images (denoted tCT and zCT, respectively). A direct mapping from ZTE to pseudo-CT was also implemented (denoted cCT). When comparing the pseudo-CT and ground truth CT images for the test set, the mean absolute error was 133, 83, and 145 Hounsfield units (HU) across the whole head, and 398, 222, and 336 HU within the skull for the tCT, zCT, and cCT images, respectively. Ultrasound simulations were also performed using the generated pseudo-CT images and compared to simulations based on CT. An annular array transducer was used targeting the visual or motor cortex. The mean differences in the simulated focal pressure, focal position, and focal volume were 9.9%, 1.5 mm, and 15.1% for simulations based on the tCT images, 5.7%, 0.6 mm, and 5.7% for the zCT, and 6.7%, 0.9 mm, and 12.1% for the cCT. The improved results for images mapped from ZTE highlight the advantage of using imaging sequences which improve contrast of the skull bone. Overall, these results demonstrate that acoustic simulations based on MR images can give comparable accuracy to those based on CT.  ( 3 min )

Precipitation forecasting is an important scientific challenge that has wide-reaching impacts on society. Historically, this challenge has been tackled using numerical weather prediction (NWP) models, grounded on physics-based simulations. Recently, many works have proposed an alternative approach, using end-to-end deep learning (DL) models to replace physics-based NWP. While these DL methods show improved performance and computational efficiency, they exhibit limitations in long-term forecasting and lack the explainability of NWP models. In this work, we present a hybrid NWP-DL workflow to fill the gap between standalone NWP and DL approaches. Under this workflow, the NWP output is fed into a deep model, which post-processes the data to yield a refined precipitation forecast. The deep model is trained with supervision, using Automatic Weather Station (AWS) observations as ground-truth labels. This can achieve the best of both worlds, and can even benefit from future improvements in NWP technology. To facilitate study in this direction, we present a novel dataset focused on the Korean Peninsula, termed KoMet (Korea Meteorological Dataset), comprised of NWP predictions and AWS observations. For NWP, we use the Global Data Assimilation and Prediction Systems-Korea Integrated Model (GDAPS-KIM).  ( 2 min )

We propose a general deep architecture for learning functions on multiple permutation-invariant sets. We also show how to generalize this architecture to sets of elements of any dimension by dimension equivariance. We demonstrate that our architecture is a universal approximator of these functions, and show superior results to existing methods on a variety of tasks including counting tasks, alignment tasks, distinguishability tasks and statistical distance measurements. This last task is quite important in Machine Learning. Although our approach is quite general, we demonstrate that it can generate approximate estimates of KL divergence and mutual information that are more accurate than previous techniques that are specifically designed to approximate those statistical distances.  ( 2 min )

This paper substantially extends our work published at ECCV, in which an intermediate-level attack was proposed to improve the transferability of some baseline adversarial examples. Specifically, we advocate a framework in which a direct linear mapping from the intermediate-level discrepancies (between adversarial features and benign features) to prediction loss of the adversarial example is established. By delving deep into the core components of such a framework, we show that 1) a variety of linear regression models can all be considered in order to establish the mapping, 2) the magnitude of the finally obtained intermediate-level adversarial discrepancy is correlated with the transferability, 3) further boost of the performance can be achieved by performing multiple runs of the baseline attack with random initialization. In addition, by leveraging these findings, we achieve new state-of-the-arts on transfer-based $\ell_\infty$ and $\ell_2$ attacks. Our code is publicly available at https://github.com/qizhangli/ila-plus-plus-lr.  ( 2 min )

Link prediction aims to predict links of a network that are not directly visible, with profound applications in biological and social systems. Despite intensive utilization of the topological feature in this task, it is unclear to what extent a particular feature can be leveraged to infer missing links. Here, we show that the maximum capability of a topological feature follows a simple mathematical expression, which is independent of how an index gauges the feature. Hence, a family of indexes associated with one topological feature shares the same performance limit. A feature's capability is lifted in the supervised prediction, which in general gives rise to better results compared with unsupervised prediction. The universality of the pattern uncovered is empirically verified by 550 structurally diverse networks, which can be applied to feature selection and the analysis of network characteristics associated with a topological feature in link prediction.  ( 2 min )

We initiate the study of online routing problems with predictions, inspired by recent exciting results in the area of learning-augmented algorithms. A learning-augmented online algorithm which incorporates predictions in a black-box manner to outperform existing algorithms if the predictions are accurate while otherwise maintaining theoretical guarantees even when the predictions are extremely erroneous is a popular framework for overcoming pessimistic worst-case competitive analysis. In this study, we particularly begin investigating the classical online traveling salesman problem (OLTSP), where future requests are augmented with predictions. Unlike the prediction models in other previous studies, each actual request in the OLTSP, associated with its arrival time and position, may not coincide with the predicted ones, which, as imagined, leads to a troublesome situation. Our main result is to study different prediction models and design algorithms to improve the best-known results in the different settings. Moreover, we generalize the proposed results to the online dial-a-ride problem.  ( 2 min )

The natural gradient field is a vector field that lives on a model equipped with a distinguished Riemannian metric, e.g. the Fisher-Rao metric, and represents the direction of steepest ascent of an objective function on the model with respect to this metric. In practice, one tries to obtain the corresponding direction on the parameter space by multiplying the ordinary gradient by the inverse of the Gram matrix associated with the metric. We refer to this vector on the parameter space as the natural parameter gradient. In this paper we study when the pushforward of the natural parameter gradient is equal to the natural gradient. Furthermore we investigate the invariance properties of the natural parameter gradient. Both questions are addressed in an overparametrised setting.  ( 2 min )

The competitive Coding approach (CompCode) is one of the most promising methods for palmprint recognition. Due to its high performance and simple formulation, it has been continuously studied for many years. However, although numerous variations of CompCode have been proposed, a detailed analysis of the method is still absent. In this paper, we provide a detailed analysis of CompCode from the perspective of linear discriminant analysis (LDA) for the first time. A non-trivial sufficient condition under which the CompCode is optimal in the sense of Fisher's criterion is presented. Based on our analysis, we examined the statistics of palmprints and concluded that CompCode deviates from the optimal condition. To mitigate the deviation, we propose a new method called Class-Specific CompCode that improves CompCode by excluding non-palm-line areas from matching. A nonlinear mapping of the competitive code is also applied in this method to further enhance accuracy. Experiments on two public databases demonstrate the effectiveness of the proposed method.  ( 2 min )

Machine learning (ML) interpretability techniques can reveal undesirable patterns in data that models exploit to make predictions--potentially causing harms once deployed. However, how to take action to address these patterns is not always clear. In a collaboration between ML and human-computer interaction researchers, physicians, and data scientists, we develop GAM Changer, the first interactive system to help domain experts and data scientists easily and responsibly edit Generalized Additive Models (GAMs) and fix problematic patterns. With novel interaction techniques, our tool puts interpretability into action--empowering users to analyze, validate, and align model behaviors with their knowledge and values. Physicians have started to use our tool to investigate and fix pneumonia and sepsis risk prediction models, and an evaluation with 7 data scientists working in diverse domains highlights that our tool is easy to use, meets their model editing needs, and fits into their current workflows. Built with modern web technologies, our tool runs locally in users' web browsers or computational notebooks, lowering the barrier to use. GAM Changer is available at the following public demo link: https://interpret.ml/gam-changer.  ( 3 min )

The use of machine learning in Structural Health Monitoring is becoming more common, as many of the inherent tasks (such as regression and classification) in developing condition-based assessment fall naturally into its remit. This chapter introduces the concept of physics-informed machine learning, where one adapts ML algorithms to account for the physical insight an engineer will often have of the structure they are attempting to model or assess. The chapter will demonstrate how grey-box models, that combine simple physics-based models with data-driven ones, can improve predictive capability in an SHM setting. A particular strength of the approach demonstrated here is the capacity of the models to generalise, with enhanced predictive capability in different regimes. This is a key issue when life-time assessment is a requirement, or when monitoring data do not span the operational conditions a structure will undergo. The chapter will provide an overview of physics-informed ML, introducing a number of new approaches for grey-box modelling in a Bayesian setting. The main ML tool discussed will be Gaussian process regression, we will demonstrate how physical assumptions/models can be incorporated through constraints, through the mean function and kernel design, and finally in a state-space setting. A range of SHM applications will be demonstrated, from loads monitoring tasks for off-shore and aerospace structures, through to performance monitoring for long-span bridges.  ( 3 min )

The recent proliferation of real-world human mobility datasets has catalyzed geospatial and transportation research in trajectory prediction, demand forecasting, travel time estimation, and anomaly detection. However, these datasets also enable, more broadly, a descriptive analysis of intricate systems of human mobility. We formally define patterns of life analysis as a natural, explainable extension of online unsupervised anomaly detection, where we not only monitor a data stream for anomalies but also explicitly extract normal patterns over time. To learn patterns of life, we adapt Grow When Required (GWR) episodic memory from research in computational biology and neurorobotics to a new domain of geospatial analysis. This biologically-inspired neural network, related to self-organizing maps (SOM), constructs a set of "memories" or prototype traffic patterns incrementally as it iterates over the GPS stream. It then compares each new observation to its prior experiences, inducing an online, unsupervised clustering and anomaly detection on the data. We mine patterns-of-interest from the Porto taxi dataset, including both major public holidays and newly-discovered transportation anomalies, such as festivals and concerts which, to our knowledge, have not been previously acknowledged or reported in prior work. We anticipate that the capability to incrementally learn normal and abnormal road transportation behavior will be useful in many domains, including smart cities, autonomous vehicles, and urban planning and management.  ( 3 min )

Active learning maximizes the hypothesis updates to find those desired unlabeled data. An inherent assumption is that this learning manner can derive those updates into the optimal hypothesis. However, its convergence may not be guaranteed well if those incremental updates are negative and disordered. In this paper, we introduce a machine teacher who provides a black-box teaching hypothesis for an active learner, where the teaching hypothesis is an effective approximation for the optimal hypothesis. Theoretically, we prove that, under the guidance of this teaching hypothesis, the learner can converge into a tighter generalization error and label complexity bound than those non-educated learners who do not receive any guidance from a teacher. We further consider two teaching scenarios: teaching a white-box and black-box learner, where self-improvement of teaching is firstly proposed to improve the teaching performance. Experiments verify this idea and show better performance than the fundamental active learning strategies, such as IWAL, IWAL-D, etc.  ( 2 min )

Reinforcement learning (RL) involves performing exploratory actions in an unknown system. This can place a learning agent in dangerous and potentially catastrophic system states. Current approaches for tackling safe learning in RL simultaneously trade-off safe exploration and task fulfillment. In this paper, we introduce a new generation of RL solvers that learn to minimise safety violations while maximising the task reward to the extent that can be tolerated by the safe policy. Our approach introduces a novel two-player framework for safe RL called Distributive Exploration Safety Training Algorithm (DESTA). The core of DESTA is a game between two adaptive agents: Safety Agent that is delegated the task of minimising safety violations and Task Agent whose goal is to maximise the environment reward. Specifically, Safety Agent can selectively take control of the system at any given point to prevent safety violations while Task Agent is free to execute its policy at any other states. This framework enables Safety Agent to learn to take actions at certain states that minimise future safety violations, both during training and testing time, while Task Agent performs actions that maximise the task performance everywhere else. Theoretically, we prove that DESTA converges to stable points enabling safety violations of pretrained policies to be minimised. Empirically, we show DESTA's ability to augment the safety of existing policies and secondly, construct safe RL policies when the Task Agent and Safety Agent are trained concurrently. We demonstrate DESTA's superior performance against leading RL methods in Lunar Lander and Frozen Lake from OpenAI gym.  ( 3 min )

Load forecasting is very essential in the analysis and grid planning of power systems. For this reason, we first propose a household load forecasting method based on federated deep learning and non-intrusive load monitoring (NILM). For all we know, this is the first research on federated learning (FL) in household load forecasting based on NILM. In this method, the integrated power is decomposed into individual device power by non-intrusive load monitoring, and the power of individual appliances is predicted separately using a federated deep learning model. Finally, the predicted power values of individual appliances are aggregated to form the total power prediction. Specifically, by separately predicting the electrical equipment to obtain the predicted power, it avoids the error caused by the strong time dependence in the power signal of a single device. And in the federated deep learning prediction model, the household owners with the power data share the parameters of the local model instead of the local power data, guaranteeing the privacy of the household user data. The case results demonstrate that the proposed approach provides a better prediction effect than the traditional methodology that directly predicts the aggregated signal as a whole. In addition, experiments in various federated learning environments are designed and implemented to validate the validity of this methodology.  ( 3 min )

Procrastination, the irrational delay of tasks, is a common occurrence in online learning. Potential negative consequences include higher risk of drop-outs, increased stress, and reduced mood. Due to the rise of learning management systems and learning analytics, indicators of such behavior can be detected, enabling predictions of future procrastination and other dilatory behavior. However, research focusing on such predictions is scarce. Moreover, studies involving different types of predictors and comparisons between the predictive performance of various methods are virtually non-existent. In this study, we aim to fill these research gaps by analyzing the performance of multiple machine learning algorithms when predicting the delayed or timely submission of online assignments in a higher education setting with two categories of predictors: subjective, questionnaire-based variables and objective, log-data based indicators extracted from a learning management system. The results show that models with objective predictors consistently outperform models with subjective predictors, and a combination of both variable types perform slightly better. For each of these three options, a different approach prevailed (Gradient Boosting Machines for the subjective, Bayesian multilevel models for the objective, and Random Forest for the combined predictors). We conclude that careful attention should be paid to the selection of predictors and algorithms before implementing such models in learning management systems.  ( 3 min )

Deep learning has excelled on complex pattern recognition tasks such as image classification and object recognition. However, it struggles with tasks requiring nontrivial reasoning, such as algorithmic computation. Humans are able to solve such tasks through iterative reasoning -- spending more time thinking about harder tasks. Most existing neural networks, however, exhibit a fixed computational budget controlled by the neural network architecture, preventing additional computational processing on harder tasks. In this work, we present a new framework for iterative reasoning with neural networks. We train a neural network to parameterize an energy landscape over all outputs, and implement each step of the iterative reasoning as an energy minimization step to find a minimal energy solution. By formulating reasoning as an energy minimization problem, for harder problems that lead to more complex energy landscapes, we may then adjust our underlying computational budget by running a more complex optimization procedure. We empirically illustrate that our iterative reasoning approach can solve more accurate and generalizable algorithmic reasoning tasks in both graph and continuous domains. Finally, we illustrate that our approach can recursively solve algorithmic problems requiring nested reasoning  ( 2 min )

A variety of fairness constraints have been proposed in the literature to mitigate group-level statistical bias. Their impacts have been largely evaluated for different groups of populations corresponding to a set of sensitive attributes, such as race or gender. Nonetheless, the community has not observed sufficient explorations for how imposing fairness constraints fare at an instance level. Building on the concept of influence function, a measure that characterizes the impact of a training example on the target model and its predictive performance, this work studies the influence of training examples when fairness constraints are imposed. We find out that under certain assumptions, the influence function with respect to fairness constraints can be decomposed into a kernelized combination of training examples. One promising application of the proposed fairness influence function is to identify suspicious training examples that may cause model discrimination by ranking their influence scores. We demonstrate with extensive experiments that training on a subset of weighty data examples leads to lower fairness violations with a trade-off of accuracy.  ( 2 min )

Learning nonparametric systems of Ordinary Differential Equations (ODEs) $\dot x = f(t,x)$ from noisy and sparse data is an emerging machine learning topic. We use the well-developed theory of Reproducing Kernel Hilbert Spaces (RKHS) to define candidates for $f$ for which the solution of the ODE exists and is unique. Learning $f$ consists of solving a constrained optimization problem in an RKHS. We propose a penalty method that iteratively uses the Representer theorem and Euler approximations to provide a numerical solution. We prove a generalization bound for the $L^2$ distance between $x$ and its estimator. Experiments are provided for the FitzHugh Nagumo oscillator and for the prediction of the Amyloid level in the cortex of aging subjects. In both cases, we show competitive results when compared with the state of the art.  ( 2 min )

We propose a novel anomaly detection method for echocardiogram videos. The introduced method takes advantage of the periodic nature of the heart cycle to learn different variants of a variational latent trajectory model (TVAE). The models are trained on the healthy samples of an in-house dataset of infant echocardiogram videos consisting of multiple chamber views to learn a normative prior of the healthy population. During inference, maximum a posteriori (MAP) based anomaly detection is performed to detect out-of-distribution samples in our dataset. The proposed method reliably identifies severe congenital heart defects, such as Ebstein's Anomaly or Shonecomplex. Moreover, it achieves superior performance over MAP-based anomaly detection with standard variational autoencoders on the task of detecting pulmonary hypertension and right ventricular dilation. Finally, we demonstrate that the proposed method provides interpretable explanations of its output through heatmaps which highlight the regions corresponding to anomalous heart structures.  ( 2 min )

This paper introduces R-MelNet, a two-part autoregressive architecture with a frontend based on the first tier of MelNet and a backend WaveRNN-style audio decoder for neural text-to-speech synthesis. Taking as input a mixed sequence of characters and phonemes, with an optional audio priming sequence, this model produces low-resolution mel-spectral features which are interpolated and used by a WaveRNN decoder to produce an audio waveform. Coupled with half precision training, R-MelNet uses under 11 gigabytes of GPU memory on a single commodity GPU (NVIDIA 2080Ti). We detail a number of critical implementation details for stable half precision training, including an approximate, numerically stable mixture of logistics attention. Using a stochastic, multi-sample per step inference scheme, the resulting model generates highly varied audio, while enabling text and audio based controls to modify output waveforms. Qualitative and quantitative evaluations of an R-MelNet system trained on a single speaker TTS dataset demonstrate the effectiveness of our approach.  ( 2 min )

Sequences arise in many real-world scenarios; thus, identifying the mechanisms behind symbol generation is essential to understanding many complex systems. This paper analyzes sequences generated by agents walking on a networked topology. Given that in many real scenarios, the underlying processes generating the sequence is hidden, we investigate whether the reconstruction of the network via the co-occurrence method is useful to recover both the network topology and agent dynamics generating sequences. We found that the characterization of reconstructed networks provides valuable information regarding the process and topology used to create the sequences. In a machine learning approach considering 16 combinations of network topology and agent dynamics as classes, we obtained an accuracy of 87% with sequences generated with less than 40% of nodes visited. Larger sequences turned out to generate improved machine learning models. Our findings suggest that the proposed methodology could be extended to classify sequences and understand the mechanisms behind sequence generation.  ( 2 min )

Machine learning (ML) may improve and automate quality control (QC) in injection moulding manufacturing. As the labelling of extensive, real-world process data is costly, however, the use of simulated process data may offer a first step towards a successful implementation. In this study, simulated data was used to develop a predictive model for the product quality of an injection moulded sorting container. The achieved accuracy, specificity and sensitivity on the test set was $99.4\%$, $99.7\%$ and $94.7\%$, respectively. This study thus shows the potential of ML towards automated QC in injection moulding and encourages the extension to ML models trained on real-world data.  ( 2 min )

Analyzing the distribution shift of data is a growing research direction in nowadays Machine Learning, leading to emerging new benchmarks that focus on providing a suitable scenario for studying the generalization properties of ML models. The existing benchmarks are focused on supervised learning, and to the best of our knowledge, there is none for unsupervised learning. Therefore, we introduce an unsupervised anomaly detection benchmark with data that shifts over time, built over Kyoto-2006+, a traffic dataset for network intrusion detection. This kind of data meets the premise of shifting the input distribution: it covers a large time span ($10$ years), with naturally occurring changes over time (\eg users modifying their behavior patterns, and software updates). We first highlight the non-stationary nature of the data, using a basic per-feature analysis, t-SNE, and an Optimal Transport approach for measuring the overall distribution distances between years. Next, we propose AnoShift, a protocol splitting the data in IID, NEAR, and FAR testing splits. We validate the performance degradation over time with diverse models (MLM to classical Isolation Forest). Finally, we show that by acknowledging the distribution shift problem and properly addressing it, the performance can be improved compared to the classical IID training (by up to $3\%$, on average). Dataset and code are available at https://github.com/bit-ml/AnoShift/.  ( 2 min )

There has been a massive increase in research interest towards applying data driven methods to problems in mechanics. While traditional machine learning (ML) methods have enabled many breakthroughs, they rely on the assumption that the training (observed) data and testing (unseen) data are independent and identically distributed (i.i.d). Thus, traditional ML approaches often break down when applied to real world mechanics problems with unknown test environments and data distribution shifts. In contrast, out-of-distribution (OOD) generalization assumes that the test data may shift (i.e., violate the i.i.d. assumption). To date, multiple methods have been proposed to improve the OOD generalization of ML methods. However, because of the lack of benchmark datasets for OOD regression problems, the efficiency of these OOD methods on regression problems, which dominate the mechanics field, remains unknown. To address this, we investigate the performance of OOD generalization methods for regression problems in mechanics. Specifically, we identify three OOD problems: covariate shift, mechanism shift, and sampling bias. For each problem, we create two benchmark examples that extend the Mechanical MNIST dataset collection, and we investigate the performance of popular OOD generalization methods on these mechanics-specific regression problems. Our numerical experiments show that in most cases, while the OOD generalization algorithms perform better compared to traditional ML methods on these OOD problems, there is a compelling need to develop more robust OOD generalization methods that are effective across multiple OOD scenarios. Overall, we expect that this study, as well as the associated open access benchmark datasets, will enable further development of OOD generalization methods for mechanics specific regression problems.  ( 3 min )

Today, machine learning is applied in almost any field. In machine learning, where there are numerous methods, classification is one of the most basic and crucial ones. Various problems can be solved by classification. The feature selection for model setup is extremely important, and producing new features via feature engineering also has a vital place in the success of the model. In our study, fraud detection classification models are built on a labeled and imbalanced dataset as a case-study. Although it is a natural language processing method, a customer space has been created with word embedding, which has been used in different areas, especially for recommender systems. The customer vectors in the created space are fed to the classification model as a feature. Moreover, to increase the number of positive labels, rows with similar characteristics are re-labeled as positive by using customer similarity determined by embedding. The model in which embedding methods are included in the classification, which provides a better representation of customers, has been compared with other models. Considering the results, it is observed that the customer embedding method had a positive effect on the success of the classification models.  ( 2 min )

Recent years have witnessed a rapid development of automated methods for skin lesion diagnosis and classification. Due to an increasing deployment of such systems in clinics, it has become important to develop a more robust system towards various Out-of-Distribution(OOD) samples (unknown skin lesions and conditions). However, the current deep learning models trained for skin lesion classification tend to classify these OOD samples incorrectly into one of their learned skin lesion categories. To address this issue, we propose a simple yet strategic approach that improves the OOD detection performance while maintaining the multi-class classification accuracy for the known categories of skin lesion. To specify, this approach is built upon a realistic scenario of a long-tailed and fine-grained OOD detection task for skin lesion images. Through this approach, 1) First, we target the mixup amongst middle and tail classes to address the long-tail problem. 2) Later, we combine the above mixup strategy with prototype learning to address the fine-grained nature of the dataset. The unique contribution of this paper is two-fold, justified by extensive experiments. First, we present a realistic problem setting of OOD task for skin lesion. Second, we propose an approach to target the long-tailed and fine-grained aspects of the problem setting simultaneously to increase the OOD performance.  ( 3 min )

Helping end users comprehend the abstract distribution shifts can greatly facilitate AI deployment. Motivated by this, we propose a novel task, dataset explanation. Given two image data sets, dataset explanation aims to automatically point out their dataset-level distribution shifts with natural language. Current techniques for monitoring distribution shifts provide inadequate information to understand datasets with the goal of improving data quality. Therefore, we introduce GSCLIP, a training-free framework to solve the dataset explanation task. In GSCLIP, we propose the selector as the first quantitative evaluation method to identify explanations that are proper to summarize dataset shifts. Furthermore, we leverage this selector to demonstrate the superiority of a generator based on language model generation. Systematic evaluation on natural data shift verifies that GSCLIP, a combined system of a hybrid generator group and an efficient selector is not only easy-to-use but also powerful for dataset explanation at scale.  ( 2 min )

Mean-field games (MFGs) are a modeling framework for systems with a large number of interacting agents. They have applications in economics, finance, and game theory. Normalizing flows (NFs) are a family of deep generative models that compute data likelihoods by using an invertible mapping, which is typically parameterized by using neural networks. They are useful for density modeling and data generation. While active research has been conducted on both models, few noted the relationship between the two. In this work, we unravel the connections between MFGs and NFs by contextualizing the training of an NF as solving the MFG. This is achieved by reformulating the MFG problem in terms of agent trajectories and parameterizing a discretization of the resulting MFG with flow architectures. With this connection, we explore two research directions. First, we employ expressive NF architectures to accurately solve high-dimensional MFGs, sidestepping the curse of dimensionality in traditional numerical methods. Compared with other deep learning approaches, our trajectory-based formulation encodes the continuity equation in the neural network, resulting in a better approximation of the population dynamics. Second, we regularize the training of NFs with transport costs and show the effectiveness on controlling the model's Lipschitz bound, resulting in better generalization performance. We demonstrate numerical results through comprehensive experiments on a variety of synthetic and real-life datasets.  ( 3 min )

Cognitive biases are mental shortcuts humans use in dealing with information and the environment, and which result in biased actions and behaviors (or, actions), unbeknownst to themselves. Biases take many forms, with cognitive biases occupying a central role that inflicts fairness, accountability, transparency, ethics, law, medicine, and discrimination. Detection of biases is considered a necessary step toward their mitigation. Herein, we focus on two cognitive biases - anchoring and recency. The recognition of cognitive bias in computer science is largely in the domain of information retrieval, and bias is identified at an aggregate level with the help of annotated data. Proposing a different direction for bias detection, we offer a principled approach along with Machine Learning to detect these two cognitive biases from Web logs of users' actions. Our individual user level detection makes it truly personalized, and does not rely on annotated data. Instead, we start with two basic principles established in cognitive psychology, use modified training of an attention network, and interpret attention weights in a novel way according to those principles, to infer and distinguish between these two biases. The personalized approach allows detection for specific users who are susceptible to these biases when performing their tasks, and can help build awareness among them so as to undertake bias mitigation.  ( 3 min )

Non-negative matrix factorization with transform learning (TL-NMF) is a recent idea that aims at learning data representations suited to NMF. In this work, we relate TL-NMF to the classical matrix joint-diagonalization (JD) problem. We show that, when the number of data realizations is sufficiently large, TL-NMF can be replaced by a two-step approach -- termed as JD+NMF -- that estimates the transform through JD, prior to NMF computation. In contrast, we found that when the number of data realizations is limited, not only is JD+NMF no longer equivalent to TL-NMF, but the inherent low-rank constraint of TL-NMF turns out to be an essential ingredient to learn meaningful transforms for NMF.  ( 2 min )

Randomly initialized wide neural networks transition to linear functions of weights as the width grows, in a ball of radius $O(1)$ around initialization. A necessary condition for this result is that all layers of the network are wide enough, i.e., all widths tend to infinity. However, the transition to linearity breaks down when this infinite width assumption is violated. In this work we show that linear networks with a bottleneck layer learn bilinear functions of the weights, in a ball of radius $O(1)$ around initialization. In general, for $B-1$ bottleneck layers, the network is a degree $B$ multilinear function of weights. Importantly, the degree only depends on the number of bottlenecks and not the total depth of the network.  ( 2 min )

Self-supervised learning representations (SSLR) have resulted in robust features for downstream tasks in many fields. Recently, several SSLRs have shown promising results on automatic speech recognition (ASR) benchmark corpora. However, previous studies have only shown performance for solitary SSLRs as an input feature for ASR models. In this study, we propose to investigate the effectiveness of diverse SSLR combinations using various fusion methods within end-to-end (E2E) ASR models. In addition, we will show there are correlations between these extracted SSLRs. As such, we further propose a feature refinement loss for decorrelation to efficiently combine the set of input features. For evaluation, we show that the proposed 'FeaRLESS learning features' perform better than systems without the proposed feature refinement loss for both the WSJ and Fearless Steps Challenge (FSC) corpora.  ( 2 min )

Humans have the remarkable ability to recognize and acquire novel visual concepts in a zero-shot manner. Given a high-level, symbolic description of a novel concept in terms of previously learned visual concepts and their relations, humans can recognize novel concepts without seeing any examples. Moreover, they can acquire new concepts by parsing and communicating symbolic structures using learned visual concepts and relations. Endowing these capabilities in machines is pivotal in improving their generalization capability at inference time. In this work, we introduce Zero-shot Concept Recognition and Acquisition (ZeroC), a neuro-symbolic architecture that can recognize and acquire novel concepts in a zero-shot way. ZeroC represents concepts as graphs of constituent concept models (as nodes) and their relations (as edges). To allow inference time composition, we employ energy-based models (EBMs) to model concepts and relations. We design ZeroC architecture so that it allows a one-to-one mapping between a symbolic graph structure of a concept and its corresponding EBM, which for the first time, allows acquiring new concepts, communicating its graph structure, and applying it to classification and detection tasks (even across domains) at inference time. We introduce algorithms for learning and inference with ZeroC. We evaluate ZeroC on a challenging grid-world dataset which is designed to probe zero-shot concept recognition and acquisition, and demonstrate its capability.  ( 3 min )

In the context of supervised machine learning a learning curve describes how a model's performance on unseen data relates to the amount of samples used to train the model. In this paper we present a dataset of plant images with representatives of crops and weeds common to the Manitoba prairies at different growth stages. We determine the learning curve for a classification task on this data with the ResNet architecture. Our results are in accordance with previous studies and add to the evidence that learning curves are governed by power-law relationships over large scales, applications, and models. We further investigate how label noise and the reduction of trainable parameters impacts the learning curve on this dataset. Both effects lead to the model requiring disproportionally larger training sets to achieve the same classification performance as observed without these effects.  ( 2 min )

Real-world knowledge graphs (KG) are mostly incomplete. The problem of recovering missing relations, called KG completion, has recently become an active research area. Knowledge graph (KG) embedding, a low-dimensional representation of entities and relations, is the crucial technique for KG completion. Convolutional neural networks in models such as ConvE, SACN, InteractE, and RGCN achieve recent successes. This paper takes a different architectural view and proposes ComDensE which combines relation-aware and common features using dense neural networks. In the relation-aware feature extraction, we attempt to create relational inductive bias by applying an encoding function specific to each relation. In the common feature extraction, we apply the common encoding function to all input embeddings. These encoding functions are implemented using dense layers in ComDensE. ComDensE achieves the state-of-the-art performance in the link prediction in terms of MRR, HIT@1 on FB15k-237 and HIT@1 on WN18RR compared to the previous baseline approaches. We conduct an extensive ablation study to examine the effects of the relation-aware layer and the common layer of the ComDensE. Experimental results illustrate that the combined dense architecture as implemented in ComDensE achieves the best performance.  ( 2 min )

Mixup refers to interpolation-based data augmentation, originally motivated as a way to go beyond empirical risk minimization (ERM). Yet, its extensions focus on the definition of interpolation and the space where it takes place, while the augmentation itself is less studied: For a mini-batch of size $m$, most methods interpolate between $m$ pairs with a single scalar interpolation factor $\lambda$. In this work, we make progress in this direction by introducing MultiMix, which interpolates an arbitrary number $n$ of tuples, each of length $m$, with one vector $\lambda$ per tuple. On sequence data, we further extend to dense interpolation and loss computation over all spatial positions. Overall, we increase the number of tuples per mini-batch by orders of magnitude at little additional cost. This is possible by interpolating at the very last layer before the classifier. Finally, to address inconsistencies due to linear target interpolation, we introduce a self-distillation approach to generate and interpolate synthetic targets. We empirically show that our contributions result in significant improvement over state-of-the-art mixup methods on four benchmarks. By analyzing the embedding space, we observe that the classes are more tightly clustered and uniformly spread over the embedding space, thereby explaining the improved behavior.  ( 2 min )

K-FAC is a successful tractable implementation of Natural Gradient for Deep Learning, which nevertheless suffers from the requirement to compute the inverse of the Kronecker factors (through an eigen-decomposition). This can be very time-consuming (or even prohibitive) when these factors are large. In this paper, we theoretically show that, owing to the exponential-average construction paradigm of the Kronecker factors that is typically used, their eigen-spectrum must decay. We show numerically that in practice this decay is very rapid, leading to the idea that we could save substantial computation by only focusing on the first few eigen-modes when inverting the Kronecker-factors. Randomized Numerical Linear Algebra provides us with the necessary tools to do so. Numerical results show we obtain $\approx2.5\times$ reduction in per-epoch time and $\approx3.3\times$ reduction in time to target accuracy. We compare our proposed K-FAC sped-up versions with a more computationally efficient NG implementation, SENG, and observe we perform on par with it.  ( 2 min )

Invariance has recently proven to be a powerful inductive bias in machine learning models. One such class of predictive or generative models are tensor networks. We introduce a new numerical algorithm to construct a basis of tensors that are invariant under the action of normal matrix representations of an arbitrary discrete group. This method can be up to several orders of magnitude faster than previous approaches. The group-invariant tensors are then combined into a group-invariant tensor train network, which can be used as a supervised machine learning model. We applied this model to a protein binding classification problem, taking into account problem-specific invariances, and obtained prediction accuracy in line with state-of-the-art deep learning approaches.  ( 2 min )

Recent research in deep learning has shown that neural networks can learn differential equations governing dynamical systems. In this paper, we adapt this concept to Virtual Analog (VA) modeling to learn the ordinary differential equations (ODEs) governing the first-order and the second-order diode clipper. The proposed models achieve performance comparable to state-of-the-art recurrent neural networks (RNNs) albeit using fewer parameters. We show that this approach does not require oversampling and allows to increase the sampling rate after the training has completed, which results in increased accuracy. Using a sophisticated numerical solver allows to increase the accuracy at the cost of slower processing. ODEs learned this way do not require closed forms but are still physically interpretable.  ( 2 min )

The size and shape of the receptive field determine how the network aggregates local information and affect the overall performance of a model considerably. Many components in a neural network, such as kernel sizes and strides for convolution and pooling operations, influence the configuration of a receptive field. However, they still rely on hyperparameters, and the receptive fields of existing models result in suboptimal shapes and sizes. Hence, we propose a simple yet effective Dynamically Optimized Pooling operation, referred to as DynOPool, which optimizes the scale factors of feature maps end-to-end by learning the desirable size and shape of its receptive field in each layer. Any kind of resizing modules in a deep neural network can be replaced by the operations with DynOPool at a minimal cost. Also, DynOPool controls the complexity of a model by introducing an additional loss term that constrains computational cost. Our experiments show that the models equipped with the proposed learnable resizing module outperform the baseline networks on multiple datasets in image classification and semantic segmentation.  ( 2 min )

We study the excess capacity of deep networks in the context of supervised classification. That is, given a capacity measure of the underlying hypothesis class -- in our case, empirical Rademacher complexity -- by how much can we (a priori) constrain this class while retaining an empirical error on a par with the unconstrained regime? To assess excess capacity in modern architectures (such as residual networks), we extend and unify prior Rademacher complexity bounds to accommodate function composition and addition, as well as the structure of convolutions. The capacity-driving terms in our bounds are the Lipschitz constants of the layers and a (2,1) group norm distance to the initializations of the convolution weights. Experiments on benchmark datasets of varying task difficulty indicate that (1) there is a substantial amount of excess capacity per task, and (2) capacity can be kept at a surprisingly similar level across tasks. Overall, this suggests a notion of compressibility with respect to weight norms, orthogonal to classic compression via weight pruning.  ( 2 min )

Multi-focus image fusion (MFIF) and super-resolution (SR) are the inverse problem of imaging model, purposes of MFIF and SR are obtaining all-in-focus and high-resolution 2D mapping of targets. Though various MFIF and SR methods have been designed; almost all the them deal with MFIF and SR separately. This paper unifies MFIF and SR problems in the physical perspective as the multi-focus image super resolution fusion (MFISRF), and we propose a novel unified dataset-free unsupervised framework named deep fusion prior (DFP) based-on deep image prior (DIP) to address such MFISRF with single model. Experiments have proved that our proposed DFP approaches or even outperforms those state-of-art MFIF and SR method combinations. To our best knowledge, our proposed work is a dataset-free unsupervised method to simultaneously implement the multi-focus fusion and super-resolution task for the first time. Additionally, DFP is a general framework, thus its networks and focus measurement tactics can be continuously updated to further improve the MFISRF performance. DFP codes are open source available at this http URL  ( 3 min )

As deep learning (DL) efficacy grows, concerns for poor model explainability grow also. Attribution methods address the issue of explainability by quantifying the importance of an input feature for a model prediction. Among various methods, Integrated Gradients (IG) sets itself apart by claiming other methods failed to satisfy desirable axioms, while IG and methods like it uniquely satisfy said axioms. This paper comments on fundamental aspects of IG and its applications/extensions: 1) We identify key differences between IG function spaces and the supporting literature's function spaces which problematize previous claims of IG uniqueness. We show that with the introduction of an additional axiom, \textit{non-decreasing positivity}, the uniqueness claims can be established. 2) We address the question of input sensitivity by identifying function classes where IG is/is not Lipschitz in the attributed input. 3) We show that axioms for single-baseline methods have analogous properties for methods with probability distribution baselines. 4) We introduce a computationally efficient method of identifying internal neurons that contribute to specified regions of an IG attribution map. Finally, we present experimental results validating this method.  ( 2 min )

Pruning neural networks reduces inference time and memory costs. On standard hardware, these benefits will be especially prominent if coarse-grained structures, like feature maps, are pruned. We devise two novel saliency-based methods for second-order structured pruning (SOSP) which include correlations among all structures and layers. Our main method SOSP-H employs an innovative second-order approximation, which enables saliency evaluations by fast Hessian-vector products. SOSP-H thereby scales like a first-order method despite taking into account the full Hessian. We validate SOSP-H by comparing it to our second method SOSP-I that uses a well-established Hessian approximation, and to numerous state-of-the-art methods. While SOSP-H performs on par or better in terms of accuracy, it has clear advantages in terms of scalability and efficiency. This allowed us to scale SOSP-H to large-scale vision tasks, even though it captures correlations across all layers of the network. To underscore the global nature of our pruning methods, we evaluate their performance not only by removing structures from a pretrained network, but also by detecting architectural bottlenecks. We show that our algorithms allow to systematically reveal architectural bottlenecks, which we then remove to further increase the accuracy of the networks.  ( 3 min )

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.  ( 3 min )

Advocates for Neuro-Symbolic Artificial Intelligence (NeSy) assert that combining deep learning with symbolic reasoning will lead to stronger AI than either paradigm on its own. As successful as deep learning has been, it is generally accepted that even our best deep learning systems are not very good at abstract reasoning. And since reasoning is inextricably linked to language, it makes intuitive sense that Natural Language Processing (NLP), would be a particularly well-suited candidate for NeSy. We conduct a structured review of studies implementing NeSy for NLP, with the aim of answering the question of whether NeSy is indeed meeting its promises: reasoning, out-of-distribution generalization, interpretability, learning and reasoning from small data, and transferability to new domains. We examine the impact of knowledge representation, such as rules and semantic networks, language structure and relational structure, and whether implicit or explicit reasoning contributes to higher promise scores. We find that systems where logic is compiled into the neural network lead to the most NeSy goals being satisfied, while other factors such as knowledge representation, or type of neural architecture do not exhibit a clear correlation with goals being met. We find many discrepancies in how reasoning is defined, specifically in relation to human level reasoning, which impact decisions about model architectures and drive conclusions which are not always consistent across studies. Hence we advocate for a more methodical approach to the application of theories of human reasoning as well as the development of appropriate benchmarks, which we hope can lead to a better understanding of progress in the field. We make our data and code available on github for further analysis.  ( 3 min )

In optimization for Machine learning (ML), it is typical that curvature-matrix (CM) estimates rely on an exponential average (EA) of local estimates (giving EA-CM algorithms). This approach has little principled justification, but is very often used in practice. In this paper, we draw a connection between EA-CM algorithms and what we call a "Wake of Quadratic regularized models". The outlined connection allows us to understand what EA-CM algorithms are doing from an optimization perspective. Generalizing from the established connection, we propose a new family of algorithms, "KL-Divergence Wake-Regularized Models" (KLD-WRM). We give three different practical instantiations of KLD-WRM, and show numerically that these outperform K-FAC on MNIST.  ( 2 min )

Contrastive learning has proven useful in many applications where access to labelled data is limited. The lack of annotated data is particularly problematic in medical image segmentation as it is difficult to have clinical experts manually annotate large volumes of data such as cardiac structures in ultrasound images of the heart. In this paper, we argue whether or not contrastive pretraining is helpful for the segmentation of the left ventricle in echocardiography images. Furthermore, we study the effect of contrastive pretraining on two well-known segmentation networks, UNet and DeepLabV3. Our results show that contrastive pretraining helps improve the performance on left ventricle segmentation, particularly when annotated data is scarce. We show how to achieve comparable results to state-of-the-art fully supervised algorithms when we train our models in a self-supervised fashion followed by fine-tuning on just 5\% of the data. We show that our solution outperforms what is currently published on a large public dataset (EchoNet-Dynamic) achieving a Dice score of 0.9211. We also compare the performance of our solution on another smaller dataset (CAMUS) to demonstrate the generalizability of our proposed solution. The code is available at (https://github.com/BioMedIA-MBZUAI/contrastive-echo).  ( 3 min )

As one of the most popular machine learning models today, graph neural networks (GNNs) have attracted intense interest recently, and so does their explainability. Users are increasingly interested in a better understanding of GNN models and their outcomes. Unfortunately, today's evaluation frameworks for GNN explainability often rely on synthetic datasets, leading to conclusions of limited scope due to a lack of complexity in the problem instances. As GNN models are deployed to more mission-critical applications, we are in dire need for a common evaluation protocol of explainability methods of GNNs. In this paper, we propose, to our best knowledge, the first systematic evaluation framework for GNN explainability, considering explainability on three different "user needs:" explanation focus, mask nature, and mask transformation. We propose a unique metric that combines the fidelity measures and classify explanations based on their quality of being sufficient or necessary. We scope ourselves to node classification tasks and compare the most representative techniques in the field of input-level explainability for GNNs. For the widely used synthetic benchmarks, surprisingly shallow techniques such as personalized PageRank have the best performance for a minimum computation time. But when the graph structure is more complex and nodes have meaningful features, gradient-based methods, in particular Saliency, are the best according to our evaluation criteria. However, none dominates the others on all evaluation dimensions and there is always a trade-off. We further apply our evaluation protocol in a case study on eBay graphs to reflect the production environment.  ( 3 min )

Recently, the artificial intelligence of things (AIoT) has been gaining increasing attention, with an intriguing vision of providing highly intelligent services through the network connection of things, leading to an advanced AI-driven ecology. However, recent regulatory restrictions on data privacy preclude uploading sensitive local data to data centers and utilizing them in a centralized approach. Directly applying federated learning algorithms in this scenario could hardly meet the industrial requirements of both efficiency and accuracy. Therefore, we propose an efficient industrial federated learning framework for AIoT in terms of a face recognition application. Specifically, we propose to utilize the concept of transfer learning to speed up federated training on devices and further present a novel design of a private projector that helps protect shared gradients without incurring additional memory consumption or computational cost. Empirical studies on a private Asian face dataset show that our approach can achieve high recognition accuracy in only 20 communication rounds, demonstrating its effectiveness in prediction and its efficiency in training.  ( 2 min )

Since the appearance of Covid-19 in late 2019, Covid-19 has become an active research topic for the artificial intelligence (AI) community. One of the most interesting AI topics is Covid-19 analysis of medical imaging. CT-scan imaging is the most informative tool about this disease. This work is part of the 2nd COV19D competition, where two challenges are set: Covid-19 Detection and Covid-19 Severity Detection from the CT-scans. For Covid-19 detection from CT-scans, we proposed an ensemble of 2D Convolution blocks with Densenet-161 models. Here, each 2D convolutional block with Densenet-161 architecture is trained separately and in testing phase, the ensemble model is based on the average of their probabilities. On the other hand, we proposed an ensemble of Convolutional Layers with Inception models for Covid-19 severity detection. In addition to the Convolutional Layers, three Inception variants were used, namely Inception-v3, Inception-v4 and Inception-Resnet. Our proposed approaches outperformed the baseline approach in the validation data of the 2nd COV19D competition by 11% and 16% for Covid-19 detection and Covid-19 severity detection, respectively.  ( 3 min )

Earnings conference calls are attracting an increasing number of researchers due to their free form and rich information. Existing studies, however, do not take speaker role information into account. Furthermore, current research does not fully account for the impact of inter-company relationships on company risk. The only study that integrates company networks and earnings conference calls constructs an undirected graph for companies holding earnings conference calls at different dates, failing to meet the requirement of no temporal information leakage for prediction tasks. To address the aforementioned issues, we propose a new model called Temporal Virtual Graph Neural Network (TVGNN), which incorporates earnings conference calls and company networks to predict company risk. For the first time, our model incorporates participant role information in dialogue modeling. Moreover, we develop a new approach to construct company networks that ensures no temporal information leakage in the graph. In experiments, our proposed model outperforms all baselines. The supplementary analyses demonstrate the model's effectiveness and interpretability.  ( 2 min )

Phase-field modeling is an effective but computationally expensive method for capturing the mesoscale morphological and microstructure evolution in materials. Hence, fast and generalizable surrogate models are needed to alleviate the cost of computationally taxing processes such as in optimization and design of materials. The intrinsic discontinuous nature of the physical phenomena incurred by the presence of sharp phase boundaries makes the training of the surrogate model cumbersome. We develop a framework that integrates a convolutional autoencoder architecture with a deep neural operator (DeepONet) to learn the dynamic evolution of a two-phase mixture and accelerate time-to-solution in predicting the microstructure evolution. We utilize the convolutional autoencoder to provide a compact representation of the microstructure data in a low-dimensional latent space. DeepONet, which consists of two sub-networks, one for encoding the input function at a fixed number of sensors locations (branch net) and another for encoding the locations for the output functions (trunk net), learns the mesoscale dynamics of the microstructure evolution from the autoencoder latent space. The decoder part of the convolutional autoencoder then reconstructs the time-evolved microstructure from the DeepONet predictions. The trained DeepONet architecture can then be used to replace the high-fidelity phase-field numerical solver in interpolation tasks or to accelerate the numerical solver in extrapolation tasks.  ( 3 min )

Neuroimaging techniques produce high-dimensional, stochastic data from which it might be challenging to extract high-level knowledge about the phenomena of interest. We address this challenge by applying the generative modelling framework to 1) classify multiple pathologies and 2) recover the neurological mechanisms of those pathologies in a data-driven manner. Our framework learns generative factors of data related to pathologies. We provide an algorithm to decode those factors further and observe how different pathologies affect observed data. We illustrate the applicability of the proposed approach to identifying schizophrenia, either followed or not by auditory verbal hallucinations. We further demonstrate the ability of the framework to learn disease-related mechanisms consistent with current domain knowledge. We also compare the proposed framework with several benchmark approaches and indicate its classification performance and interpretability advantages.  ( 2 min )

Federated learning is a powerful distributed learning scheme that allows numerous edge devices to collaboratively train a model without sharing their data. However, training is resource-intensive for edge devices, and limited network bandwidth is often the main bottleneck. Prior work often overcomes the constraints by condensing the models or messages into compact formats, e.g., by gradient compression or distillation. In contrast, we propose ProgFed, the first progressive training framework for efficient and effective federated learning. It inherently reduces computation and two-way communication costs while maintaining the strong performance of the final models. We theoretically prove that ProgFed converges at the same asymptotic rate as standard training on full models. Extensive results on a broad range of architectures, including CNNs (VGG, ResNet, ConvNets) and U-nets, and diverse tasks from simple classification to medical image segmentation show that our highly effective training approach saves up to $20\%$ computation and up to $63\%$ communication costs for converged models. As our approach is also complimentary to prior work on compression, we can achieve a wide range of trade-offs by combining these techniques, showing reduced communication of up to $50\times$ at only $0.1\%$ loss in utility. Code is available at https://github.com/a514514772/ProgFed.  ( 3 min )

Since MDLatLRR only considers detailed parts (salient features) of input images extracted by latent low-rank representation (LatLRR), it doesn't use base parts (principal features) extracted by LatLRR effectively. Therefore, we proposed an improved multi-level decomposition method called MDLatLRRv2 which effectively analyzes and utilizes all the image features obtained by LatLRR. Then we apply MDLatLRRv2 to medical image fusion. The base parts are fused by average strategy and the detail parts are fused by nuclear-norm operation. The comparison with the existing methods demonstrates that the proposed method can achieve state-of-the-art fusion performance in objective and subjective assessment.  ( 2 min )

The loss surface of an overparameterized neural network (NN) possesses many global minima of zero training error. We explain how common variants of the standard NN training procedure change the minimizer obtained. First, we make explicit how the size of the initialization of a strongly overparameterized NN affects the minimizer and can deteriorate its final test performance. We propose a strategy to limit this effect. Then, we demonstrate that for adaptive optimization such as AdaGrad, the obtained minimizer generally differs from the gradient descent (GD) minimizer. This adaptive minimizer is changed further by stochastic mini-batch training, even though in the non-adaptive case, GD and stochastic GD result in essentially the same minimizer. Lastly, we explain that these effects remain relevant for less overparameterized NNs. While overparameterization has its benefits, our work highlights that it induces sources of error absent from underparameterized models.  ( 2 min )

As a neurophysiological response to threat or adverse conditions, stress can affect cognition, emotion and behaviour with potentially detrimental effects on health in the case of sustained exposure. Since the affective content of speech is inherently modulated by an individual's physical and mental state, a substantial body of research has been devoted to the study of paralinguistic correlates of stress-inducing task load. Historically, voice stress analysis (VSA) has been conducted using conventional digital signal processing (DSP) techniques. Despite the development of modern methods based on deep neural networks (DNNs), accurately detecting stress in speech remains difficult due to the wide variety of stressors and considerable variability in the individual stress perception. To that end, we introduce a set of five datasets for task load detection in speech. The voice recordings were collected as either cognitive or physical stress was induced in the cohort of volunteers, with a cumulative number of more than a hundred speakers. We used the datasets to design and evaluate a novel self-supervised audio representation that leverages the effectiveness of handcrafted features (DSP-based) and the complexity of data-driven DNN representations. Notably, the proposed approach outperformed both extensive handcrafted feature sets and novel DNN-based audio representation learning approaches.  ( 3 min )

Generalization across different environments with the same tasks is critical for successful applications of visual reinforcement learning (RL) in real scenarios. However, visual distractions -- which are common in real scenes -- from high-dimensional observations can be hurtful to the learned representations in visual RL, thus degrading the performance of generalization. To tackle this problem, we propose a novel approach, namely Characteristic Reward Sequence Prediction (CRESP), to extract the task-relevant information by learning reward sequence distributions (RSDs), as the reward signals are task-relevant in RL and invariant to visual distractions. Specifically, to effectively capture the task-relevant information via RSDs, CRESP introduces an auxiliary task -- that is, predicting the characteristic functions of RSDs -- to learn task-relevant representations, because we can well approximate the high-dimensional distributions by leveraging the corresponding characteristic functions. Experiments demonstrate that CRESP significantly improves the performance of generalization on unseen environments, outperforming several state-of-the-arts on DeepMind Control tasks with different visual distractions.  ( 3 min )

We investigate pneumatic non-prehensile manipulation (i.e., blowing) as a means of efficiently moving scattered objects into a target receptacle. Due to the chaotic nature of aerodynamic forces, a blowing controller must (i) continually adapt to unexpected changes from its actions, (ii) maintain fine-grained control, since the slightest misstep can result in large unintended consequences (e.g., scatter objects already in a pile), and (iii) infer long-range plans (e.g., move the robot to strategic blowing locations). We tackle these challenges in the context of deep reinforcement learning, introducing a multi-frequency version of the spatial action maps framework. This allows for efficient learning of vision-based policies that effectively combine high-level planning and low-level closed-loop control for dynamic mobile manipulation. Experiments show that our system learns efficient behaviors for the task, demonstrating in particular that blowing achieves better downstream performance than pushing, and that our policies improve performance over baselines. Moreover, we show that our system naturally encourages emergent specialization between the different subpolicies spanning low-level fine-grained control and high-level planning. On a real mobile robot equipped with a miniature air blower, we show that our simulation-trained policies transfer well to a real environment and can generalize to novel objects.  ( 3 min )

As the machine learning and systems communities strive to achieve higher energy-efficiency through custom deep neural network (DNN) accelerators, varied precision or quantization levels, and model compression techniques, there is a need for design space exploration frameworks that incorporate quantization-aware processing elements into the accelerator design space while having accurate and fast power, performance, and area models. In this work, we present QUIDAM, a highly parameterized quantization-aware DNN accelerator and model co-exploration framework. Our framework can facilitate future research on design space exploration of DNN accelerators for various design choices such as bit precision, processing element type, scratchpad sizes of processing elements, global buffer size, number of total processing elements, and DNN configurations. Our results show that different bit precisions and processing element types lead to significant differences in terms of performance per area and energy. Specifically, our framework identifies a wide range of design points where performance per area and energy varies more than 5x and 35x, respectively. With the proposed framework, we show that lightweight processing elements achieve on par accuracy results and up to 5.7x more performance per area and energy improvement when compared to the best INT16 based implementation. Finally, due to the efficiency of the pre-characterized power, performance, and area models, QUIDAM can speed up the design exploration process by 3-4 orders of magnitude as it removes the need for expensive synthesis and characterization of each design.  ( 3 min )

This paper studies a transferable phoneme embedding framework that aims to deal with the cross-lingual text-to-speech (TTS) problem under the few-shot setting. Transfer learning is a common approach when it comes to few-shot learning since training from scratch on few-shot training data is bound to overfit. Still, we find that the naive transfer learning approach fails to adapt to unseen languages under extremely few-shot settings, where less than 8 minutes of data is provided. We deal with the problem by proposing a framework that consists of a phoneme-based TTS model and a codebook module to project phonemes from different languages into a learned latent space. Furthermore, by utilizing phoneme-level averaged self-supervised learned features, we effectively improve the quality of synthesized speeches. Experiments show that using 4 utterances, which is about 30 seconds of data, is enough to synthesize intelligible speech when adapting to an unseen language using our framework.

Cut selection is a subroutine used in all modern mixed-integer linear programming solvers with the goal of selecting a subset of generated cuts that induce optimal solver performance. These solvers have millions of parameter combinations, and so are excellent candidates for parameter tuning. Cut selection scoring rules are usually weighted sums of different measurements, where the weights are parameters. We present a parametric family of mixed-integer linear programs together with infinitely many family-wide valid cuts. Some of these cuts can induce integer optimal solutions directly after being applied, while others fail to do so even if an infinite amount are applied. We show for a specific cut selection rule, that any finite grid search of the parameter space will always miss all parameter values, which select integer optimal inducing cuts in an infinite amount of our problems. We propose a variation on the design of existing graph convolutional neural networks, adapting them to learn cut selection rule parameters. We present a reinforcement learning framework for selecting cuts, and train our design using said framework over MIPLIB 2017. Our framework and design show that adaptive cut selection does substantially improve performance over a diverse set of instances, but that finding a single function describing such a rule is difficult. Code for reproducing all experiments is available at https://github.com/Opt-Mucca/Adaptive-Cutsel-MILP.  ( 3 min )

Using a model of the environment and a value function, an agent can construct many estimates of a state's value, by unrolling the model for different lengths and bootstrapping with its value function. Our key insight is that one can treat this set of value estimates as a type of ensemble, which we call an \emph{implicit value ensemble} (IVE). Consequently, the discrepancy between these estimates can be used as a proxy for the agent's epistemic uncertainty; we term this signal \emph{model-value inconsistency} or \emph{self-inconsistency} for short. Unlike prior work which estimates uncertainty by training an ensemble of many models and/or value functions, this approach requires only the single model and value function which are already being learned in most model-based reinforcement learning algorithms. We provide empirical evidence in both tabular and function approximation settings from pixels that self-inconsistency is useful (i) as a signal for exploration, (ii) for acting safely under distribution shifts, and (iii) for robustifying value-based planning with a learned model.  ( 3 min )

Recent contrastive learning methods achieved state-of-the-art in low label regimes. However, the training requires large batch sizes and heavy augmentations to create multiple views of an image. With non-contrastive methods, the negatives are implicitly incorporated in the loss, allowing different images and modalities as pairs. Although the meta-information (i.e., age, sex) in medical imaging is abundant, the annotations are noisy and prone to class imbalance. In this work, we exploited already existing temporal information (different visits from a patient) in a longitudinal optical coherence tomography (OCT) dataset using temporally informed non-contrastive loss (TINC) without increasing complexity and need for negative pairs. Moreover, our novel pair-forming scheme can avoid heavy augmentations and implicitly incorporates the temporal information in the pairs. Finally, these representations learned from the pretraining are more successful in predicting disease progression where the temporal information is crucial for the downstream task. More specifically, our model outperforms existing models in predicting the risk of conversion within a time frame from intermediate age-related macular degeneration (AMD) to the late wet-AMD stage.  ( 2 min )

In this work we study the problem of Subspace Tracking with missing data (ST-miss) and outliers (Robust ST-miss). We propose a novel algorithm, and provide a guarantee for both these problems. Unlike past work on this topic, the current work does not impose the piecewise constant subspace change assumption. Additionally, the proposed algorithm is much simpler (uses fewer parameters) than our previous work. Secondly, we extend our approach and its analysis to provably solving these problems when the data is federated and when the over-air data communication modality is used for information exchange between the $K$ peer nodes and the center. We validate our theoretical claims with extensive numerical experiments.  ( 2 min )

Deep learning on large-scale data is dominant nowadays. The unprecedented scale of data has been arguably one of the most important driving forces for the success of deep learning. However, there still exist scenarios where collecting data or labels could be extremely expensive, e.g., medical imaging and robotics. To fill up this gap, this paper considers the problem of data-efficient learning from scratch using a small amount of representative data. First, we characterize this problem by active learning on homeomorphic tubes of spherical manifolds. This naturally generates feasible hypothesis class. With homologous topological properties, we identify an important connection -- finding tube manifolds is equivalent to minimizing hyperspherical energy (MHE) in physical geometry. Inspired by this connection, we propose a MHE-based active learning (MHEAL) algorithm, and provide comprehensive theoretical guarantees for MHEAL, covering convergence and generalization analysis. Finally, we demonstrate the empirical performance of MHEAL in a wide range of applications on data-efficient learning, including deep clustering, distribution matching, version space sampling and deep active learning.  ( 2 min )

In recent years, the introduction of the Transformer models sparked a revolution in natural language processing (NLP). BERT was one of the first text encoders using only the attention mechanism without any recurrent parts to achieve state-of-the-art results on many NLP tasks. This paper introduces a text classifier using topological data analysis. We use BERT's attention maps transformed into attention graphs as the only input to that classifier. The model can solve tasks such as distinguishing spam from ham messages, recognizing whether a sentence is grammatically correct, or evaluating a movie review as negative or positive. It performs comparably to the BERT baseline and outperforms it on some tasks. Additionally, we propose a new method to reduce the number of BERT's attention heads considered by the topological classifier, which allows us to prune the number of heads from 144 down to as few as ten with no reduction in performance. Our work also shows that the topological model displays higher robustness against adversarial attacks than the original BERT model, which is maintained during the pruning process. To the best of our knowledge, this work is the first to confront topological-based models with adversarial attacks in the context of NLP.  ( 2 min )

Models that generate extractive rationales (i.e., subsets of features) or natural language explanations (NLEs) for their predictions are important for explainable AI. While an extractive rationale provides a quick view of the features most responsible for a prediction, an NLE allows for a comprehensive description of the decision-making process behind a prediction. However, current models that generate the best extractive rationales or NLEs often fall behind the state-of-the-art (SOTA) in terms of task performance. In this work, we bridge this gap by introducing RExC, a self-rationalizing framework that grounds its predictions and two complementary types of explanations (NLEs and extractive rationales) in background knowledge. Our framework improves over previous methods by: (i) reaching SOTA task performance while also providing explanations, (ii) providing two types of explanations, while existing models usually provide only one type, and (iii) beating by a large margin the previous SOTA in terms of quality of both types of explanations. Furthermore, a perturbation analysis in RExC shows a high degree of association between explanations and predictions, a necessary property of faithful explanations.  ( 3 min )

Traditional approaches based on finite element analyses have been successfully used to predict the macro-scale behavior of heterogeneous materials (composites, multicomponent alloys, and polycrystals) widely used in industrial applications. However, this necessitates the mesh size to be smaller than the characteristic length scale of the microstructural heterogeneities in the material leading to computationally expensive and time-consuming calculations. The recent advances in deep learning based image super-resolution (SR) algorithms open up a promising avenue to tackle this computational challenge by enabling researchers to enhance the spatio-temporal resolution of data obtained from coarse mesh simulations. However, technical challenges still remain in developing a high-fidelity SR model for application to computational solid mechanics, especially for materials undergoing large deformation. This work aims at developing a physics-informed deep learning based super-resolution framework (PhySRNet) which enables reconstruction of high-resolution deformation fields (displacement and stress) from their low-resolution counterparts without requiring high-resolution labeled data. We design a synthetic case study to illustrate the effectiveness of the proposed framework and demonstrate that the super-resolved fields match the accuracy of an advanced numerical solver running at 400 times the coarse mesh resolution while simultaneously satisfying the (highly nonlinear) governing laws. The approach opens the door to applying machine learning and traditional numerical approaches in tandem to reduce computational complexity accelerate scientific discovery and engineering design.

Understanding generalization in modern machine learning settings has been one of the major challenges in statistical learning theory. In this context, recent years have witnessed the development of various generalization bounds suggesting different complexity notions such as the mutual information between the data sample and the algorithm output, compressibility of the hypothesis space, and the fractal dimension of the hypothesis space. While these bounds have illuminated the problem at hand from different angles, their suggested complexity notions might appear seemingly unrelated, thereby restricting their high-level impact. In this study, we prove novel generalization bounds through the lens of rate-distortion theory, and explicitly relate the concepts of mutual information, compressibility, and fractal dimensions in a single mathematical framework. Our approach consists of (i) defining a generalized notion of compressibility by using source coding concepts, and (ii) showing that the `compression error rate' can be linked to the generalization error both in expectation and with high probability. We show that in the `lossless compression' setting, we recover and improve existing mutual information-based bounds, whereas a `lossy compression' scheme allows us to link generalization to the rate-distortion dimension -- a particular notion of fractal dimension. Our results bring a more unified perspective on generalization and open up several future research directions.  ( 3 min )

Telehealth helps to facilitate access to medical professionals by enabling remote medical services for the patients. These services have become gradually popular over the years with the advent of necessary technological infrastructure. The benefits of telehealth have been even more apparent since the beginning of the COVID-19 crisis, as people have become less inclined to visit doctors in person during the pandemic. In this paper, we focus on facilitating the chat sessions between a doctor and a patient. We note that the quality and efficiency of the chat experience can be critical as the demand for telehealth services increases. Accordingly, we develop a smart auto-response generation mechanism for medical conversations that helps doctors respond to consultation requests efficiently, particularly during busy sessions. We explore over 900,000 anonymous, historical online messages between doctors and patients collected over nine months. We implement clustering algorithms to identify the most frequent responses by doctors and manually label the data accordingly. We then train machine learning algorithms using this preprocessed data to generate the responses. The considered algorithm has two steps: a filtering (i.e., triggering) model to filter out infeasible patient messages and a response generator to suggest the top-3 doctor responses for the ones that successfully pass the triggering phase. The method provides an accuracy of 83.28\% for precision@3 and shows robustness to its parameters.  ( 3 min )

Computational learning approaches to solving visual reasoning tests, such as Raven's Progressive Matrices (RPM), critically depend on the ability to identify the visual concepts used in the test (i.e., the representation) as well as the latent rules based on those concepts (i.e., the reasoning). However, learning of representation and reasoning is a challenging and ill-posed task, often approached in a stage-wise manner (first representation, then reasoning). In this work, we propose an end-to-end joint representation-reasoning learning framework, which leverages a weak form of inductive bias to improve both tasks together. Specifically, we introduce a general generative graphical model for RPMs, GM-RPM, and apply it to solve the reasoning test. We accomplish this using a novel learning framework Disentangling based Abstract Reasoning Network (DAReN) based on the principles of GM-RPM. We perform an empirical evaluation of DAReN over several benchmark datasets. DAReN shows consistent improvement over state-of-the-art (SOTA) models on both the reasoning and the disentanglement tasks. This demonstrates the strong correlation between disentangled latent representation and the ability to solve abstract visual reasoning tasks.  ( 2 min )

Wasserstein GANs with Gradient Penalty (WGAN-GP) are a very popular method for training generative models to produce high quality synthetic data. While WGAN-GP were initially developed to calculate the Wasserstein 1 distance between generated and real data, recent works (e.g. [23]) have provided empirical evidence that this does not occur, and have argued that WGAN-GP perform well not in spite of this issue, but because of it. In this paper we show for the first time that WGAN-GP compute the minimum of a different optimal transport problem, the so-called congested transport [7]. Congested transport determines the cost of moving one distribution to another under a transport model that penalizes congestion. For WGAN-GP, we find that the congestion penalty has a spatially varying component determined by the sampling strategy used in [12] which acts like a local speed limit, making congestion cost less in some regions than others. This aspect of the congested transport problem is new, in that the congestion penalty turns out to be unbounded and depends on the distributions to be transported, and so we provide the necessary mathematical proofs for this setting. One facet of our discovery is a formula connecting the gradient of solutions to the optimization problem in WGAN-GP to the time averaged momentum of the optimal mass flow. This is in contrast to the gradient of Kantorovich potentials for the Wasserstein 1 distance, which is just the normalized direction of flow. Based on this and other considerations, we speculate on how our results explain the observed performance of WGAN-GP. Beyond applications to GANs, our theorems also point to the possibility of approximately solving large scale congested transport problems using neural network techniques.  ( 3 min )

Realistic manipulation tasks require a robot to interact with an environment with a prolonged sequence of motor actions. While deep reinforcement learning methods have recently emerged as a promising paradigm for automating manipulation behaviors, they usually fall short in long-horizon tasks due to the exploration burden. This work introduces Manipulation Primitive-augmented reinforcement Learning (MAPLE), a learning framework that augments standard reinforcement learning algorithms with a pre-defined library of behavior primitives. These behavior primitives are robust functional modules specialized in achieving manipulation goals, such as grasping and pushing. To use these heterogeneous primitives, we develop a hierarchical policy that involves the primitives and instantiates their executions with input parameters. We demonstrate that MAPLE outperforms baseline approaches by a significant margin on a suite of simulated manipulation tasks. We also quantify the compositional structure of the learned behaviors and highlight our method's ability to transfer policies to new task variants and to physical hardware. Videos and code are available at https://ut-austin-rpl.github.io/maple  ( 2 min )

Model selection in contextual bandits is an important complementary problem to regret minimization with respect to a fixed model class. We consider the simplest non-trivial instance of model-selection: distinguishing a simple multi-armed bandit problem from a linear contextual bandit problem. Even in this instance, current state-of-the-art methods explore in a suboptimal manner and require strong "feature-diversity" conditions. In this paper, we introduce new algorithms that a) explore in a data-adaptive manner, and b) provide model selection guarantees of the form $\mathcal{O}(d^{\alpha} T^{1- \alpha})$ with no feature diversity conditions whatsoever, where $d$ denotes the dimension of the linear model and $T$ denotes the total number of rounds. The first algorithm enjoys a "best-of-both-worlds" property, recovering two prior results that hold under distinct distributional assumptions, simultaneously. The second removes distributional assumptions altogether, expanding the scope for tractable model selection. Our approach extends to model selection among nested linear contextual bandits under some additional assumptions.  ( 2 min )

Many modern machine learning algorithms such as generative adversarial networks (GANs) and adversarial training can be formulated as minimax optimization. Gradient descent ascent (GDA) is the most commonly used algorithm due to its simplicity. However, GDA can converge to non-optimal minimax points. We propose a new minimax optimization framework, GDA-AM, that views the GDAdynamics as a fixed-point iteration and solves it using Anderson Mixing to con-verge to the local minimax. It addresses the diverging issue of simultaneous GDAand accelerates the convergence of alternating GDA. We show theoretically that the algorithm can achieve global convergence for bilinear problems under mild conditions. We also empirically show that GDA-AMsolves a variety of minimax problems and improves GAN training on several datasets  ( 2 min )

Human learners can readily understand speech, or a melody, when it is presented slower or faster than usual. Although deep convolutional neural networks (CNNs) are extremely powerful in extracting information from time series, they require explicit training to generalize to different time scales. This paper presents a deep CNN that incorporates a temporal representation inspired by recent findings from neuroscience. In the mammalian brain, time is represented by populations of neurons with temporal receptive fields. Critically, the peaks of the receptive fields form a geometric series, such that the population codes a set of temporal basis functions over log time. Because memory for the recent past is a function of log time, rescaling the input results in translation of the memory. The Scale-Invariant Temporal History Convolution network (SITHCon) builds a convolutional layer over this logarithmically-distributed temporal memory. A max-pool operation results in a network that is invariant to rescalings of time modulo edge effects. We compare performance of SITHCon to a Temporal Convolution Network (TCN). Although both networks can learn classification and regression problems on both univariate and multivariate time series f(t), only SITHCon generalizes to rescalings f(at). This property, inspired by findings from contemporary neuroscience and consistent with findings from cognitive psychology, may enable networks that learn with fewer training examples, fewer weights and that generalize more robustly to out of sample data.  ( 3 min )

Identification of nonlinear dynamic systems remains a significant challenge across engineering. This work suggests an approach based on Bayesian filtering to extract and identify the contribution of an unknown nonlinear term in the system which can be seen as an alternative viewpoint on restoring force surface type approaches. To achieve this identification, the contribution which is the nonlinear restoring force is modelled, initially, as a Gaussian process in time. That Gaussian process is converted into a state-space model and combined with the linear dynamic component of the system. Then, by inference of the filtering and smoothing distributions, the internal states of the system and the nonlinear restoring force can be extracted. In possession of these states a nonlinear model can be constructed. The approach is demonstrated to be effective in both a simulated case study and on an experimental benchmark dataset.  ( 2 min )

Prompt tuning is an emerging way of adapting pre-trained language models to downstream tasks. However, the existing studies are mainly to add prompts to the input sequence. This way would not work as expected due to the intermediate multi-head self-attention and feed-forward network computation, making model optimization not very smooth. Hence, we propose a novel tuning way called layer tuning, aiming to add learnable parameters in Transformer layers. Specifically, we focus on layer tuning for feed-forward network in the Transformer, namely FL-tuning. It introduces additional units into the hidden layer of each feed-forward network. We conduct extensive experiments on the public CLUE benchmark. The results show that: 1) Our FL-tuning outperforms prompt tuning methods under both full-data and few-shot settings in almost all cases. In particular, it improves accuracy by 17.93% (full-data setting) on WSC 1.0 and F1 by 16.142% (few-shot setting) on CLUENER over P-tuning v2. 2) Our FL-tuning is more stable and converges about 1.17 times faster than P-tuning v2. 3) With only about 3% of Transformer's parameters to be trained, FL-tuning is comparable with fine-tuning on most datasets, and significantly outperforms fine-tuning (e.g., accuracy improved by 12.9% on WSC 1.1) on several datasets. The source codes are available at https://github.com/genggui001/FL-Tuning.  ( 2 min )

Our world is full of asymmetries. Gravity and wind can make reaching a place easier than coming back. Social artifacts such as genealogy charts and citation graphs are inherently directed. In reinforcement learning and control, optimal goal-reaching strategies are rarely reversible (symmetrical). Distance functions supported on these asymmetrical structures are called quasimetrics. Despite their common appearance, little research has been done on the learning of quasimetrics. Our theoretical analysis reveals that a common class of learning algorithms, including unconstrained multilayer perceptrons (MLPs), provably fails to learn a quasimetric consistent with training data. In contrast, our proposed Poisson Quasimetric Embedding (PQE) is the first quasimetric learning formulation that both is learnable with gradient-based optimization and enjoys strong performance guarantees. Experiments on random graphs, social graphs, and offline Q-learning demonstrate its effectiveness over many common baselines.  ( 2 min )

We present a single-stage casual waveform-to-waveform multichannel model that can separate moving sound sources based on their broad spatial locations in a dynamic acoustic scene. We divide the scene into two spatial regions containing, respectively, the target and the interfering sound sources. The model is trained end-to-end and performs spatial processing implicitly, without any components based on traditional processing or use of hand-crafted spatial features. We evaluate the proposed model on a real-world dataset and show that the model matches the performance of an oracle beamformer followed by a state-of-the-art single-channel enhancement network.

A common classification task situation is where one has a large amount of data available for training, but only a small portion is annotated with class labels. The goal of semi-supervised training, in this context, is to improve classification accuracy by leverage information not only from labeled data but also from a large amount of unlabeled data. Recent works have developed significant improvements by exploring the consistency constrain between differently augmented labeled and unlabeled data. Following this path, we propose a novel unsupervised objective that focuses on the less studied relationship between the high confidence unlabeled data that are similar to each other. The new proposed Pair Loss minimizes the statistical distance between high confidence pseudo labels with similarity above a certain threshold. Combining the Pair Loss with the techniques developed by the MixMatch family, our proposed SimPLE algorithm shows significant performance gains over previous algorithms on CIFAR-100 and Mini-ImageNet, and is on par with the state-of-the-art methods on CIFAR-10 and SVHN. Furthermore, SimPLE also outperforms the state-of-the-art methods in the transfer learning setting, where models are initialized by the weights pre-trained on ImageNet or DomainNet-Real. The code is available at github.com/zijian-hu/SimPLE.  ( 3 min )

The human annotations are imperfect, especially when produced by junior practitioners. Multi-expert consensus is usually regarded as golden standard, while this annotation protocol is too expensive to implement in many real-world projects. In this study, we propose a method to refine human annotation, named Neural Annotation Refinement (NeAR). It is based on a learnable implicit function, which decodes a latent vector into represented shape. By integrating the appearance as an input of implicit functions, the appearance-aware NeAR fixes the annotation artefacts. Our method is demonstrated on the application of adrenal gland analysis. We first show that the NeAR can repair distorted golden standards on a public adrenal gland segmentation dataset. Besides, we develop a new Adrenal gLand ANalysis (ALAN) dataset with the proposed NeAR, where each case consists of a 3D shape of adrenal gland and its diagnosis label (normal vs. abnormal) assigned by experts. We show that models trained on the shapes repaired by the NeAR can diagnose adrenal glands better than the original ones. The ALAN dataset will be open-source, with 1,594 shapes for adrenal gland diagnosis, which serves as a new benchmark for medical shape analysis. Code and dataset are available at https://github.com/M3DV/NeAR.  ( 3 min )

The recent spike in certified Artificial Intelligence (AI) tools for healthcare has renewed the debate around adoption of this technology. One thread of such debate concerns Explainable AI and its promise to render AI devices more transparent and trustworthy. A few voices active in the medical AI space have expressed concerns on the reliability of Explainable AI techniques, questioning their use and inclusion in guidelines and standards. Revisiting such criticisms, this article offers a balanced and comprehensive perspective on the utility of Explainable AI, focusing on the specificity of clinical applications of AI and placing them in the context of healthcare interventions. Against its detractors and despite valid concerns, we argue that the Explainable AI research program is still central to human-machine interaction and ultimately our main tool against loss of control, a danger that cannot be prevented by rigorous clinical validation alone.

The second-order optimization methods, notably the D-KFAC (Distributed Kronecker Factored Approximate Curvature) algorithms, have gained traction on accelerating deep neural network (DNN) training on GPU clusters. However, existing D-KFAC algorithms require to compute and communicate a large volume of second-order information, i.e., Kronecker factors (KFs), before preconditioning gradients, resulting in large computation and communication overheads as well as a high memory footprint. In this paper, we propose DP-KFAC, a novel distributed preconditioning scheme that distributes the KF constructing tasks at different DNN layers to different workers. DP-KFAC not only retains the convergence property of the existing D-KFAC algorithms but also enables three benefits: reduced computation overhead in constructing KFs, no communication of KFs, and low memory footprint. Extensive experiments on a 64-GPU cluster show that DP-KFAC reduces the computation overhead by 1.55x-1.65x, the communication cost by 2.79x-3.15x, and the memory footprint by 1.14x-1.47x in each second-order update compared to the state-of-the-art D-KFAC methods.

Devising and analyzing learning models for spatiotemporal network data is of importance for tasks including forecasting, anomaly detection, and multi-agent coordination, among others. Graph Convolutional Neural Networks (GCNNs) are an established approach to learn from time-invariant network data. The graph convolution operation offers a principled approach to aggregate multiresolution information. However, extending the convolution principled learning and respective analysis to the spatiotemporal domain is challenging because spatiotemporal data have more intrinsic dependencies. Hence, a higher flexibility to capture jointly the spatial and the temporal dependencies is required to learn meaningful higher-order representations. Here, we leverage product graphs to represent the spatiotemporal dependencies in the data and introduce Graph-Time Convolutional Neural Networks (GTCNNs) as a principled architecture to aid learning. The proposed approach can work with any type of product graph and we also introduce a parametric product graph to learn also the spatiotemporal coupling. The convolution principle further allows a similar mathematical tractability as for GCNNs. In particular, the stability result shows GTCNNs are stable to spatial perturbations but there is an implicit trade-off between discriminability and robustness; i.e., the more complex the model, the less stable. Extensive numerical results on benchmark datasets corroborate our findings and show the GTCNN compares favorably with state-of-the-art solutions. We anticipate the GTCNN to be a starting point for more sophisticated models that achieve good performance but are also fundamentally grounded.

Representation learning has become a practical family of methods for building rich parametric codifications of massive high-dimensional data while succeeding in the reconstruction side. When considering unsupervised tasks with test-train distribution shifts, the probabilistic viewpoint helps for addressing overconfidence and poor calibration of predictions. However, the direct introduction of Bayesian inference on top of neural networks weights is still an ardous problem for multiple reasons, i.e. the curse of dimensionality or intractability issues. The Laplace approximation (LA) offers a solution here, as one may build Gaussian approximations of the posterior density of weights via second-order Taylor expansions in certain locations of the parameter space. In this work, we present a Bayesian autoencoder for unsupervised representation learning inspired in LA. Our method implements iterative Laplace updates to obtain a novel variational lower-bound of the autoencoder evidence. The vast computational burden of the second-order partial derivatives is skipped via approximations of the Hessian matrix. Empirically, we demonstrate the scalability and performance of the Laplacian autoencoder by providing well-calibrated uncertainties for out-of-distribution detection, geodesics for differential geometry and missing data imputations.

Besides standard cameras, autonomous vehicles typically include multiple additional sensors, such as lidars and radars, which help acquire richer information for perceiving the content of the driving scene. While several recent works focus on fusing certain pairs of sensors - such as camera and lidar or camera and radar - by using architectural components specific to the examined setting, a generic and modular sensor fusion architecture is missing from the literature. In this work, we focus on 2D object detection, a fundamental high-level task which is defined on the 2D image domain, and propose HRFuser, a multi-resolution sensor fusion architecture that scales straightforwardly to an arbitrary number of input modalities. The design of HRFuser is based on state-of-the-art high-resolution networks for image-only dense prediction and incorporates a novel multi-window cross-attention block as the means to perform fusion of multiple modalities at multiple resolutions. Even though cameras alone provide very informative features for 2D detection, we demonstrate via extensive experiments on the nuScenes and Seeing Through Fog datasets that our model effectively leverages complementary features from additional modalities, substantially improving upon camera-only performance and consistently outperforming state-of-the-art fusion methods for 2D detection both in normal and adverse conditions. The source code will be made publicly available.

Finding equilibria points in continuous minimax games has become a key problem within machine learning, in part due to its connection to the training of generative adversarial networks. Because of existence and robustness issues, recent developments have shifted from pure equilibria to focusing on mixed equilibria points. In this note we consider a method proposed by Domingo-Enrich et al. for finding mixed equilibria in two-layer zero-sum games. The method is based on entropic regularisation and the two competing strategies are represented by two sets of interacting particles. We show that the sequence of empirical measures of the particle system satisfies a large deviation principle as the number of particles grows to infinity, and how this implies convergence of the empirical measure and the associated Nikaid\^o-Isoda error, complementing existing law of large numbers results.

We study the problem of learning the parameters for the Hamiltonian of a quantum many-body system, given limited access to the system. In this work, we build upon recent approaches to Hamiltonian learning via derivative estimation. We propose a protocol that improves the scaling dependence of prior works, particularly with respect to parameters relating to the structure of the Hamiltonian (e.g., its locality $k$). Furthermore, by deriving exact bounds on the performance of our protocol, we are able to provide a precise numerical prescription for theoretically optimal settings of hyperparameters in our learning protocol, such as the maximum evolution time (when learning with unitary dynamics) or minimum temperature (when learning with Gibbs states). Thanks to these improvements, our protocol is practical for large problems: we demonstrate this with a numerical simulation of our protocol on an 80-qubit system.

Significant theoretical work has established that in specific regimes, neural networks trained by gradient descent behave like kernel methods. However, in practice, it is known that neural networks strongly outperform their associated kernels. In this work, we explain this gap by demonstrating that there is a large class of functions which cannot be efficiently learned by kernel methods but can be easily learned with gradient descent on a two layer neural network outside the kernel regime by learning representations that are relevant to the target task. We also demonstrate that these representations allow for efficient transfer learning, which is impossible in the kernel regime. Specifically, we consider the problem of learning polynomials which depend on only a few relevant directions, i.e. of the form $f^\star(x) = g(Ux)$ where $U: \R^d \to \R^r$ with $d \gg r$. When the degree of $f^\star$ is $p$, it is known that $n \asymp d^p$ samples are necessary to learn $f^\star$ in the kernel regime. Our primary result is that gradient descent learns a representation of the data which depends only on the directions relevant to $f^\star$. This results in an improved sample complexity of $n\asymp d^2 r + dr^p$. Furthermore, in a transfer learning setup where the data distributions in the source and target domain share the same representation $U$ but have different polynomial heads we show that a popular heuristic for transfer learning has a target sample complexity independent of $d$.

Most of the existing methods for estimating the local intrinsic dimension of a data distribution do not scale well to high-dimensional data. Many of them rely on a non-parametric nearest neighbors approach which suffers from the curse of dimensionality. We attempt to address that challenge by proposing a novel approach to the problem: Local Intrinsic Dimension estimation using approximate Likelihood (LIDL). Our method relies on an arbitrary density estimation method as its subroutine and hence tries to sidestep the dimensionality challenge by making use of the recent progress in parametric neural methods for likelihood estimation. We carefully investigate the empirical properties of the proposed method, compare them with our theoretical predictions, and show that LIDL yields competitive results on the standard benchmarks for this problem and that it scales to thousands of dimensions. What is more, we anticipate this approach to improve further with the continuing advances in the density estimation literature.

Anomaly detection in multivariate time series plays an important role in monitoring the behaviors of various real-world systems, e.g., IT system operations or manufacturing industry. Previous approaches model the joint distribution without considering the underlying mechanism of multivariate time series, making them complicated and computationally hungry. In this paper, we formulate the anomaly detection problem from a causal perspective and view anomalies as instances that do not follow the regular causal mechanism to generate the multivariate data. We then propose a causality-based anomaly detection approach, which first learns the causal structure from data and then infers whether an instance is an anomaly relative to the local causal mechanism to generate each variable from its direct causes, whose conditional distribution can be directly estimated from data. In light of the modularity property of causal systems, the original problem is divided into a series of separate low-dimensional anomaly detection problems so that where an anomaly happens can be directly identified. We evaluate our approach with both simulated and public datasets as well as a case study on real-world AIOps applications, showing its efficacy, robustness, and practical feasibility.

Previous Part-Of-Speech (POS) induction models usually assume certain independence assumptions (e.g., Markov, unidirectional, local dependency) that do not hold in real languages. For example, the subject-verb agreement can be both long-term and bidirectional. To facilitate flexible dependency modeling, we propose a Masked Part-of-Speech Model (MPoSM), inspired by the recent success of Masked Language Models (MLM). MPoSM can model arbitrary tag dependency and perform POS induction through the objective of masked POS reconstruction. We achieve competitive results on both the English Penn WSJ dataset as well as the universal treebank containing 10 diverse languages. Though modeling the long-term dependency should ideally help this task, our ablation study shows mixed trends in different languages. To better understand this phenomenon, we design a novel synthetic experiment that can specifically diagnose the model's ability to learn tag agreement. Surprisingly, we find that even strong baselines fail to solve this problem consistently in a very simplified setting: the agreement between adjacent words. Nonetheless, MPoSM achieves overall better performance. Lastly, we conduct a detailed error analysis to shed light on other remaining challenges. Our code is available at https://github.com/owenzx/MPoSM  ( 2 min )

Nowadays, Breast cancer has risen to become one of the most prominent causes of death in recent years. Among all malignancies, this is the most frequent and the major cause of death for women globally. Manually diagnosing this disease requires a good amount of time and expertise. Breast cancer detection is time-consuming, and the spread of the disease can be reduced by developing machine-based breast cancer predictions. In Machine learning, the system can learn from prior instances and find hard-to-detect patterns from noisy or complicated data sets using various statistical, probabilistic, and optimization approaches. This work compares several machine learning algorithm's classification accuracy, precision, sensitivity, and specificity on a newly collected dataset. In this work Decision tree, Random Forest, Logistic Regression, Naive Bayes, and XGBoost, these five machine learning approaches have been implemented to get the best performance on our dataset. This study focuses on finding the best algorithm that can forecast breast cancer with maximum accuracy in terms of its classes. This work evaluated the quality of each algorithm's data classification in terms of efficiency and effectiveness. And also compared with other published work on this domain. After implementing the model, this study achieved the best model accuracy, 94% on Random Forest and XGBoost.  ( 3 min )

Generative adversarial networks (GANs) have proven to be surprisingly efficient for image editing by inverting and manipulating the latent code corresponding to an input real image. This editing property emerges from the disentangled nature of the latent space. In this paper, we identify that the facial attribute disentanglement is not optimal, thus facial editing relying on linear attribute separation is flawed. We thus propose to improve semantic disentanglement with supervision. Our method consists in learning a proxy latent representation using normalizing flows, and we show that this leads to a more efficient space for face image editing.  ( 2 min )

Bilevel optimization has been applied to a wide variety of machine learning models. Numerous stochastic bilevel optimization algorithms have been developed in recent years. However, most of them restrict their focus on the single-machine setting so that they are incapable of handling the distributed data. To address this issue, under the setting where all participants compose a network and perform the peer-to-peer communication in this network, we developed two novel distributed stochastic bilevel optimization algorithms based on the gradient tracking communication mechanism and two different gradient estimators. Additionally, we show that they can achieve $O(\frac{1}{\epsilon^{2}(1-\lambda)^2})$ and $O(\frac{1}{\epsilon^{3/2}(1-\lambda)^2})$ convergence rate respectively to obtain the $\epsilon$-accuracy solution, where $1-\lambda$ denotes the spectral gap of the communication network. To our knowledge, this is the first work achieving these theoretical results. Finally, we applied our algorithms to practical machine learning models, and the experimental results confirmed the efficacy of our algorithms.  ( 2 min )

We study the problem of model selection in bandit scenarios in the presence of nested policy classes, with the goal of obtaining simultaneous adversarial and stochastic ("best of both worlds") high-probability regret guarantees. Our approach requires that each base learner comes with a candidate regret bound that may or may not hold, while our meta algorithm plays each base learner according to a schedule that keeps the base learner's candidate regret bounds balanced until they are detected to violate their guarantees. We develop careful mis-specification tests specifically designed to blend the above model selection criterion with the ability to leverage the (potentially benign) nature of the environment. We recover the model selection guarantees of the CORRAL algorithm for adversarial environments, but with the additional benefit of achieving high probability regret bounds, specifically in the case of nested adversarial linear bandits. More importantly, our model selection results also hold simultaneously in stochastic environments under gap assumptions. These are the first theoretical results that achieve best of both world (stochastic and adversarial) guarantees while performing model selection in (linear) bandit scenarios.  ( 2 min )

Traffic demand forecasting by deep neural networks has attracted widespread interest in both academia and industry society. Among them, the pairwise Origin-Destination (OD) demand prediction is a valuable but challenging problem due to several factors: (i) the large number of possible OD pairs, (ii) implicitness of spatial dependence, and (iii) complexity of traffic states. To address the above issues, this paper proposes a Continuous-time and Multi-level dynamic graph representation learning method for Origin-Destination demand prediction (CMOD). Firstly, a continuous-time dynamic graph representation learning framework is constructed, which maintains a dynamic state vector for each traffic node (metro stations or taxi zones). The state vectors keep historical transaction information and are continuously updated according to the most recently happened transactions. Secondly, a multi-level structure learning module is proposed to model the spatial dependency of station-level nodes. It can not only exploit relations between nodes adaptively from data, but also share messages and representations via cluster-level and area-level virtual nodes. Lastly, a cross-level fusion module is designed to integrate multi-level memories and generate comprehensive node representations for the final prediction. Extensive experiments are conducted on two real-world datasets from Beijing Subway and New York Taxi, and the results demonstrate the superiority of our model against the state-of-the-art approaches.  ( 3 min )

The expressive and computationally inexpensive bipartite Graph Neural Networks (GNN) have been shown to be an important component of deep learning based Mixed-Integer Linear Program (MILP) solvers. Recent works have demonstrated the effectiveness of such GNNs in replacing the branching (variable selection) heuristic in branch-and-bound (B&B) solvers. These GNNs are trained, offline and on a collection of MILPs, to imitate a very good but computationally expensive branching heuristic, strong branching. Given that B&B results in a tree of sub-MILPs, we ask (a) whether there are strong dependencies exhibited by the target heuristic among the neighboring nodes of the B&B tree, and (b) if so, whether we can incorporate them in our training procedure. Specifically, we find that with the strong branching heuristic, a child node's best choice was often the parent's second-best choice. We call this the "lookback" phenomenon. Surprisingly, the typical branching GNN of Gasse et al. (2019) often misses this simple "answer". To imitate the target behavior more closely by incorporating the lookback phenomenon in GNNs, we propose two methods: (a) target smoothing for the standard cross-entropy loss function, and (b) adding a Parent-as-Target (PAT) Lookback regularizer term. Finally, we propose a model selection framework to incorporate harder-to-formulate objectives such as solving time in the final models. Through extensive experimentation on standard benchmark instances, we show that our proposal results in up to 22% decrease in the size of the B&B tree and up to 15% improvement in the solving times.  ( 3 min )

This work seeks to center validity considerations in deliberations around whether and how to build data-driven algorithms in high-stakes domains. Toward this end, we translate key concepts from validity theory to predictive algorithms. We describe common challenges in problem formulation and data issues that jeopardize the validity of predictive algorithms. We distill these issues into a series of high-level questions intended to promote and document reflections on the legitimacy of the predictive task and the suitability of the data. This contribution lays the foundation for co-designing a validity protocol, in collaboration with real-world stakeholders, including decision-makers, modelers, and members of potentially impacted communities, to critically evaluate the justifiability of specific designs and uses of data-driven algorithmic systems.  ( 2 min )

Here, we present a method called Manifold Interpolating Optimal-Transport Flow (MIOFlow) that learns stochastic, continuous population dynamics from static snapshot samples taken at sporadic timepoints. MIOFlow combines dynamic models, manifold learning, and optimal transport by training neural ordinary differential equations (Neural ODE) to interpolate between static population snapshots as penalized by optimal transport with manifold ground distance. Further, we ensure that the flow follows the geometry by operating in the latent space of an autoencoder that we call a geodesic autoencoder (GAE). In GAE the latent space distance between points is regularized to match a novel multiscale geodesic distance on the data manifold that we define. We show that this method is superior to normalizing flows, Schr\"odinger bridges and other generative models that are designed to flow from noise to data in terms of interpolating between populations. Theoretically, we link these trajectories with dynamic optimal transport. We evaluate our method on simulated data with bifurcations and merges, as well as scRNA-seq data from embryoid body differentiation, and acute myeloid leukemia treatment.  ( 2 min )

Semi-Supervised Learning (SSL) is fundamentally a missing label problem, in which the label Missing Not At Random (MNAR) problem is more realistic and challenging, compared to the widely-adopted yet naive Missing Completely At Random assumption where both labeled and unlabeled data share the same class distribution. Different from existing SSL solutions that overlook the role of "class" in causing the non-randomness, e.g., users are more likely to label popular classes, we explicitly incorporate "class" into SSL. Our method is three-fold: 1) We propose Class-Aware Propensity (CAP) that exploits the unlabeled data to train an improved classifier using the biased labeled data. 2) To encourage rare class training, whose model is low-recall but high-precision that discards too many pseudo-labeled data, we propose Class-Aware Imputation (CAI) that dynamically decreases (or increases) the pseudo-label assignment threshold for rare (or frequent) classes. 3) Overall, we integrate CAP and CAI into a Class-Aware Doubly Robust (CADR) estimator for training an unbiased SSL model. Under various MNAR settings and ablations, our method not only significantly outperforms existing baselines but also surpasses other label bias removal SSL methods. Please check our code at: https://github.com/JoyHuYY1412/CADR-FixMatch.  ( 2 min )

Ensembles of deep neural networks have demonstrated superior performance, but their heavy computational cost hinders applying them for resource-limited environments. It motivates distilling knowledge from the ensemble teacher into a smaller student network, and there are two important design choices for this ensemble distillation: 1) how to construct the student network, and 2) what data should be shown during training. In this paper, we propose a weight averaging technique where a student with multiple subnetworks is trained to absorb the functional diversity of ensemble teachers, but then those subnetworks are properly averaged for inference, giving a single student network with no additional inference cost. We also propose a perturbation strategy that seeks inputs from which the diversities of teachers can be better transferred to the student. Combining these two, our method significantly improves upon previous methods on various image classification tasks.  ( 2 min )

Physiological measurements involves observing variables that attribute to the normative functioning of human systems and subsystems directly or indirectly. The measurements can be used to detect affective states of a person with aims such as improving human-computer interactions. There are several methods of collecting physiological data, but wearable sensors are a common, non-invasive tool for accurate readings. However, valuable information is hard to extract from the raw physiological data, especially for affective state detection. Machine Learning techniques are used to detect the affective state of a person through labeled physiological data. A clear problem with using labeled data is creating accurate labels. An expert is needed to analyze a form of recording of participants and mark sections with different states such as stress and calm. While expensive, this method delivers a complete dataset with labeled data that can be used in any number of supervised algorithms. An interesting question arises from the expensive labeling: how can we reduce the cost while maintaining high accuracy? Semi-Supervised learning (SSL) is a potential solution to this problem. These algorithms allow for machine learning models to be trained with only a small subset of labeled data (unlike unsupervised which use no labels). They provide a way of avoiding expensive labeling. This paper compares a fully supervised algorithm to a SSL on the public WESAD (Wearable Stress and Affect Detection) Dataset for stress detection. This paper shows that Semi-Supervised algorithms are a viable method for inexpensive affective state detection systems with accurate results.  ( 3 min )

Recently, a family of locally balanced (LB) samplers has demonstrated excellent performance at sampling and learning energy-based models (EBMs) in discrete spaces. However, the theoretical understanding of this success is limited. In this work, we show how LB functions give rise to LB dynamics corresponding to Wasserstein gradient flow in a discrete space. From first principles, previous LB samplers can then be seen as discretizations of the LB dynamics with respect to Hamming distance. Based on this observation, we propose a new algorithm, the Locally Balanced Jump (LBJ), by discretizing the LB dynamics with respect to simulation time. As a result, LBJ has a location-dependent "velocity" that allows it to make proposals with larger distances. Additionally, LBJ decouples each dimension into independent sub-processes, enabling convenient parallel implementation. We demonstrate the advantages of LBJ for sampling and learning in various binary and categorical distributions.  ( 2 min )

Electromyography signals can be used as training data by machine learning models to classify various gestures. We seek to produce a model that can classify six different hand gestures with a limited number of samples that generalizes well to a wider audience while comparing the effect of our feature extraction results on model accuracy to other more conventional methods such as the use of AR parameters on a sliding window across the channels of a signal. We appeal to a set of more elementary methods such as the use of random bounds on a signal, but desire to show the power these methods can carry in an online setting where EMG classification is being conducted, as opposed to more complicated methods such as the use of the Fourier Transform. To augment our limited training data, we used a standard technique, known as jitter, where random noise is added to each observation in a channel wise manner. Once all datasets were produced using the above methods, we performed a grid search with Random Forest and XGBoost to ultimately create a high accuracy model. For human computer interface purposes, high accuracy classification of EMG signals is of particular importance to their functioning and given the difficulty and cost of amassing any sort of biomedical data in a high volume, it is valuable to have techniques that can work with a low amount of high-quality samples with less expensive feature extraction methods that can reliably be carried out in an online application.  ( 3 min )

Data privacy and class imbalance are the norm rather than the exception in many machine learning tasks. Recent attempts have been launched to, on one side, address the problem of learning from pervasive private data, and on the other side, learn from long-tailed data. However, both assumptions might hold in practical applications, while an effective method to simultaneously alleviate both issues is yet under development. In this paper, we focus on learning with long-tailed (LT) data distributions under the context of the popular privacy-preserved federated learning (FL) framework. We characterize three scenarios with different local or global long-tailed data distributions in the FL framework, and highlight the corresponding challenges. The preliminary results under different scenarios reveal that substantial future work are of high necessity to better resolve the characterized federated long-tailed learning tasks.  ( 2 min )

Language models have achieved remarkable performance on a wide range of tasks that require natural language understanding. Nevertheless, state-of-the-art models have generally struggled with tasks that require quantitative reasoning, such as solving mathematics, science, and engineering problems at the college level. To help close this gap, we introduce Minerva, a large language model pretrained on general natural language data and further trained on technical content. The model achieves state-of-the-art performance on technical benchmarks without the use of external tools. We also evaluate our model on over two hundred undergraduate-level problems in physics, biology, chemistry, economics, and other sciences that require quantitative reasoning, and find that the model can correctly answer nearly a third of them.  ( 2 min )

There have been several post-hoc explanation approaches developed to explain pre-trained black-box neural networks. However, there is still a gap in research efforts toward designing neural networks that are inherently explainable. In this paper, we utilize a recently proposed instance-wise post-hoc causal explanation method to make an existing transformer architecture inherently explainable. Once trained, our model provides an explanation in the form of top-$k$ regions in the input space of the given instance contributing to its decision. We evaluate our method on binary classification tasks using three image datasets: MNIST, FMNIST, and CIFAR. Our results demonstrate that compared to the causality-based post-hoc explainer model, our inherently explainable model achieves better explainability results while eliminating the need of training a separate explainer model. Our code is available at https://github.com/mvrl/CAT-XPLAIN.  ( 2 min )

Nonsmooth optimization finds wide applications in many engineering fields. In this work, we propose to utilize the {Randomized Coordinate Subgradient Method} (RCS) for solving both nonsmooth convex and nonsmooth nonconvex (nonsmooth weakly convex) optimization problems. At each iteration, RCS randomly selects one block coordinate rather than all the coordinates to update. Motivated by practical applications, we consider the {linearly bounded subgradients assumption} for the objective function, which is much more general than the Lipschitz continuity assumption. Under such a general assumption, we conduct thorough convergence analysis for RCS in both convex and nonconvex cases and establish both expected convergence rate and almost sure asymptotic convergence results. In order to derive these convergence results, we establish a convergence lemma and the relationship between the global metric subregularity properties of a weakly convex function and its Moreau envelope, which are fundamental and of independent interests. Finally, we conduct several experiments to show the possible superiority of RCS over the subgradient method.  ( 2 min )

Physics-informed neural network (PINN) algorithms have shown promising results in solving a wide range of problems involving partial differential equations (PDEs). However, they often fail to converge to desirable solutions when the target function contains high-frequency features, due to a phenomenon known as spectral bias. In the present work, we exploit neural tangent kernels (NTKs) to investigate the training dynamics of PINNs evolving under stochastic gradient descent with momentum (SGDM). This demonstrates SGDM significantly reduces the effect of spectral bias. We have also examined why training a model via the Adam optimizer can accelerate the convergence while reducing the spectral bias. Moreover, our numerical experiments have confirmed that wide-enough networks using SGDM still converge to desirable solutions, even in the presence of high-frequency features. In fact, we show that the width of a network plays a critical role in convergence.  ( 2 min )

In this paper, we design, analyze the convergence properties and address the implementation aspects of AFAFed. This is a novel Asynchronous Fair Adaptive Federated learning framework for stream-oriented IoT application environments, which are featured by time-varying operating conditions, heterogeneous resource-limited devices (i.e., coworkers), non-i.i.d. local training data and unreliable communication links. The key new of AFAFed is the synergic co-design of: (i) two sets of adaptively tuned tolerance thresholds and fairness coefficients at the coworkers and central server, respectively; and, (ii) a distributed adaptive mechanism, which allows each coworker to adaptively tune own communication rate. The convergence properties of AFAFed under (possibly) non-convex loss functions is guaranteed by a set of new analytical bounds, which formally unveil the impact on the resulting AFAFed convergence rate of a number of Federated Learning (FL) parameters, like, first and second moments of the per-coworker number of consecutive model updates, data skewness, communication packet-loss probability, and maximum/minimum values of the (adaptively tuned) mixing coefficient used for model aggregation.  ( 2 min )

We present a modified tuning of the algorithm of Zimmert and Seldin [2020] for adversarial multiarmed bandits with delayed feedback, which in addition to the minimax optimal adversarial regret guarantee shown by Zimmert and Seldin simultaneously achieves a near-optimal regret guarantee in the stochastic setting with fixed delays. Specifically, the adversarial regret guarantee is $\mathcal{O}(\sqrt{TK} + \sqrt{dT\log K})$, where $T$ is the time horizon, $K$ is the number of arms, and $d$ is the fixed delay, whereas the stochastic regret guarantee is $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{d}{\Delta_{i}\log K}) + d K^{1/3}\log K\right)$, where $\Delta_i$ are the suboptimality gaps. We also present an extension of the algorithm to the case of arbitrary delays, which is based on an oracle knowledge of the maximal delay $d_{max}$ and achieves $\mathcal{O}(\sqrt{TK} + \sqrt{D\log K} + d_{max}K^{1/3} \log K)$ regret in the adversarial regime, where $D$ is the total delay, and $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{\sigma_{max}}{\Delta_{i}\log K}) + d_{max}K^{1/3}\log K\right)$ regret in the stochastic regime, where $\sigma_{max}$ is the maximal number of outstanding observations. Finally, we present a lower bound that matches regret upper bound achieved by the skipping technique of Zimmert and Seldin [2020] in the adversarial setting.  ( 2 min )

Online influence maximization aims to maximize the influence spread of a content in a social network with unknown network model by selecting a few seed nodes. Recent studies followed a non-adaptive setting, where the seed nodes are selected before the start of the diffusion process and network parameters are updated when the diffusion stops. We consider an adaptive version of content-dependent online influence maximization problem where the seed nodes are sequentially activated based on real-time feedback. In this paper, we formulate the problem as an infinite-horizon discounted MDP under a linear diffusion process and present a model-based reinforcement learning solution. Our algorithm maintains a network model estimate and selects seed users adaptively, exploring the social network while improving the optimal policy optimistically. We establish $\widetilde O(\sqrt{T})$ regret bound for our algorithm. Empirical evaluations on synthetic network demonstrate the efficiency of our algorithm.  ( 2 min )

The success of DNNs is driven by the counter-intuitive ability of over-parameterized networks to generalize, even when they perfectly fit the training data. In practice, test error often continues to decrease with increasing over-parameterization, referred to as double descent. This allows practitioners to instantiate large models without having to worry about over-fitting. Despite its benefits, however, prior work has shown that over-parameterization can exacerbate bias against minority subgroups. Several fairness-constrained DNN training methods have been proposed to address this concern. Here, we critically examine MinDiff, a fairness-constrained training procedure implemented within TensorFlow's Responsible AI Toolkit, that aims to achieve Equality of Opportunity. We show that although MinDiff improves fairness for under-parameterized models, it is likely to be ineffective in the over-parameterized regime. This is because an overfit model with zero training loss is trivially group-wise fair on training data, creating an "illusion of fairness," thus turning off the MinDiff optimization (this will apply to any disparity-based measures which care about errors or accuracy. It won't apply to demographic parity). Within specified fairness constraints, under-parameterized MinDiff models can even have lower error compared to their over-parameterized counterparts (despite baseline over-parameterized models having lower error). We further show that MinDiff optimization is very sensitive to choice of batch size in the under-parameterized regime. Thus, fair model training using MinDiff requires time-consuming hyper-parameter searches. Finally, we suggest using previously proposed regularization techniques, viz. L2, early stopping and flooding in conjunction with MinDiff to train fair over-parameterized models.  ( 3 min )

From the nature of dark matter to the rate of expansion of our Universe, observations of distant galaxies distorted through strong gravitational lensing have the potential to answer some of the major open questions in astrophysics. Modeling galaxy-galaxy strong lensing observations presents a number of challenges as the exact configuration of both the background source and foreground lens galaxy is unknown. A timely call, prompted by a number of upcoming surveys anticipating high-resolution lensing images, demands methods that can efficiently model lenses at their full complexity. In this work, we introduce a method that uses continuous neural fields to non-parametrically reconstruct the complex morphology of a source galaxy while simultaneously inferring a distribution over foreground lens galaxy configurations. We demonstrate the efficacy of our method through experiments on simulated data targeting high-resolution lensing images similar to those anticipated in near-future astrophysical surveys.  ( 2 min )

We study the excess capacity of deep networks in the context of supervised classification. That is, given a capacity measure of the underlying hypothesis class -- in our case, empirical Rademacher complexity -- by how much can we (a priori) constrain this class while retaining an empirical error on a par with the unconstrained regime? To assess excess capacity in modern architectures (such as residual networks), we extend and unify prior Rademacher complexity bounds to accommodate function composition and addition, as well as the structure of convolutions. The capacity-driving terms in our bounds are the Lipschitz constants of the layers and a (2,1) group norm distance to the initializations of the convolution weights. Experiments on benchmark datasets of varying task difficulty indicate that (1) there is a substantial amount of excess capacity per task, and (2) capacity can be kept at a surprisingly similar level across tasks. Overall, this suggests a notion of compressibility with respect to weight norms, orthogonal to classic compression via weight pruning.  ( 2 min )

In optimization for Machine learning (ML), it is typical that curvature-matrix (CM) estimates rely on an exponential average (EA) of local estimates (giving EA-CM algorithms). This approach has little principled justification, but is very often used in practice. In this paper, we draw a connection between EA-CM algorithms and what we call a "Wake of Quadratic regularized models". The outlined connection allows us to understand what EA-CM algorithms are doing from an optimization perspective. Generalizing from the established connection, we propose a new family of algorithms, "KL-Divergence Wake-Regularized Models" (KLD-WRM). We give three different practical instantiations of KLD-WRM, and show numerically that these outperform K-FAC on MNIST.  ( 2 min )

Identification of nonlinear dynamic systems remains a significant challenge across engineering. This work suggests an approach based on Bayesian filtering to extract and identify the contribution of an unknown nonlinear term in the system which can be seen as an alternative viewpoint on restoring force surface type approaches. To achieve this identification, the contribution which is the nonlinear restoring force is modelled, initially, as a Gaussian process in time. That Gaussian process is converted into a state-space model and combined with the linear dynamic component of the system. Then, by inference of the filtering and smoothing distributions, the internal states of the system and the nonlinear restoring force can be extracted. In possession of these states a nonlinear model can be constructed. The approach is demonstrated to be effective in both a simulated case study and on an experimental benchmark dataset.  ( 2 min )

Understanding generalization in modern machine learning settings has been one of the major challenges in statistical learning theory. In this context, recent years have witnessed the development of various generalization bounds suggesting different complexity notions such as the mutual information between the data sample and the algorithm output, compressibility of the hypothesis space, and the fractal dimension of the hypothesis space. While these bounds have illuminated the problem at hand from different angles, their suggested complexity notions might appear seemingly unrelated, thereby restricting their high-level impact. In this study, we prove novel generalization bounds through the lens of rate-distortion theory, and explicitly relate the concepts of mutual information, compressibility, and fractal dimensions in a single mathematical framework. Our approach consists of (i) defining a generalized notion of compressibility by using source coding concepts, and (ii) showing that the `compression error rate' can be linked to the generalization error both in expectation and with high probability. We show that in the `lossless compression' setting, we recover and improve existing mutual information-based bounds, whereas a `lossy compression' scheme allows us to link generalization to the rate-distortion dimension -- a particular notion of fractal dimension. Our results bring a more unified perspective on generalization and open up several future research directions.  ( 3 min )

We present a modified tuning of the algorithm of Zimmert and Seldin [2020] for adversarial multiarmed bandits with delayed feedback, which in addition to the minimax optimal adversarial regret guarantee shown by Zimmert and Seldin simultaneously achieves a near-optimal regret guarantee in the stochastic setting with fixed delays. Specifically, the adversarial regret guarantee is $\mathcal{O}(\sqrt{TK} + \sqrt{dT\log K})$, where $T$ is the time horizon, $K$ is the number of arms, and $d$ is the fixed delay, whereas the stochastic regret guarantee is $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{d}{\Delta_{i}\log K}) + d K^{1/3}\log K\right)$, where $\Delta_i$ are the suboptimality gaps. We also present an extension of the algorithm to the case of arbitrary delays, which is based on an oracle knowledge of the maximal delay $d_{max}$ and achieves $\mathcal{O}(\sqrt{TK} + \sqrt{D\log K} + d_{max}K^{1/3} \log K)$ regret in the adversarial regime, where $D$ is the total delay, and $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{\sigma_{max}}{\Delta_{i}\log K}) + d_{max}K^{1/3}\log K\right)$ regret in the stochastic regime, where $\sigma_{max}$ is the maximal number of outstanding observations. Finally, we present a lower bound that matches regret upper bound achieved by the skipping technique of Zimmert and Seldin [2020] in the adversarial setting.  ( 2 min )

Most of the existing methods for estimating the local intrinsic dimension of a data distribution do not scale well to high-dimensional data. Many of them rely on a non-parametric nearest neighbors approach which suffers from the curse of dimensionality. We attempt to address that challenge by proposing a novel approach to the problem: Local Intrinsic Dimension estimation using approximate Likelihood (LIDL). Our method relies on an arbitrary density estimation method as its subroutine and hence tries to sidestep the dimensionality challenge by making use of the recent progress in parametric neural methods for likelihood estimation. We carefully investigate the empirical properties of the proposed method, compare them with our theoretical predictions, and show that LIDL yields competitive results on the standard benchmarks for this problem and that it scales to thousands of dimensions. What is more, we anticipate this approach to improve further with the continuing advances in the density estimation literature.  ( 2 min )

Randomly initialized wide neural networks transition to linear functions of weights as the width grows, in a ball of radius $O(1)$ around initialization. A necessary condition for this result is that all layers of the network are wide enough, i.e., all widths tend to infinity. However, the transition to linearity breaks down when this infinite width assumption is violated. In this work we show that linear networks with a bottleneck layer learn bilinear functions of the weights, in a ball of radius $O(1)$ around initialization. In general, for $B-1$ bottleneck layers, the network is a degree $B$ multilinear function of weights. Importantly, the degree only depends on the number of bottlenecks and not the total depth of the network.  ( 2 min )

Forward modeling approaches in cosmology have made it possible to reconstruct the initial conditions at the beginning of the Universe from the observed survey data. However the high dimensionality of the parameter space still poses a challenge to explore the full posterior, with traditional algorithms such as Hamiltonian Monte Carlo (HMC) being computationally inefficient due to generating correlated samples and the performance of variational inference being highly dependent on the choice of divergence (loss) function. Here we develop a hybrid scheme, called variational self-boosted sampling (VBS) to mitigate the drawbacks of both these algorithms by learning a variational approximation for the proposal distribution of Monte Carlo sampling and combine it with HMC. The variational distribution is parameterized as a normalizing flow and learnt with samples generated on the fly, while proposals drawn from it reduce auto-correlation length in MCMC chains. Our normalizing flow uses Fourier space convolutions and element-wise operations to scale to high dimensions. We show that after a short initial warm-up and training phase, VBS generates better quality of samples than simple VI approaches and reduces the correlation length in the sampling phase by a factor of 10-50 over using only HMC to explore the posterior of initial conditions in 64$^3$ and 128$^3$ dimensional problems, with larger gains for high signal-to-noise data observations.  ( 3 min )

Significant theoretical work has established that in specific regimes, neural networks trained by gradient descent behave like kernel methods. However, in practice, it is known that neural networks strongly outperform their associated kernels. In this work, we explain this gap by demonstrating that there is a large class of functions which cannot be efficiently learned by kernel methods but can be easily learned with gradient descent on a two layer neural network outside the kernel regime by learning representations that are relevant to the target task. We also demonstrate that these representations allow for efficient transfer learning, which is impossible in the kernel regime. Specifically, we consider the problem of learning polynomials which depend on only a few relevant directions, i.e. of the form $f^\star(x) = g(Ux)$ where $U: \R^d \to \R^r$ with $d \gg r$. When the degree of $f^\star$ is $p$, it is known that $n \asymp d^p$ samples are necessary to learn $f^\star$ in the kernel regime. Our primary result is that gradient descent learns a representation of the data which depends only on the directions relevant to $f^\star$. This results in an improved sample complexity of $n\asymp d^2 r + dr^p$. Furthermore, in a transfer learning setup where the data distributions in the source and target domain share the same representation $U$ but have different polynomial heads we show that a popular heuristic for transfer learning has a target sample complexity independent of $d$.  ( 3 min )

Recent work on deep learning for tabular data demonstrates the strong performance of deep tabular models, often bridging the gap between gradient boosted decision trees and neural networks. Accuracy aside, a major advantage of neural models is that they learn reusable features and are easily fine-tuned in new domains. This property is often exploited in computer vision and natural language applications, where transfer learning is indispensable when task-specific training data is scarce. In this work, we demonstrate that upstream data gives tabular neural networks a decisive advantage over widely used GBDT models. We propose a realistic medical diagnosis benchmark for tabular transfer learning, and we present a how-to guide for using upstream data to boost performance with a variety of tabular neural network architectures. Finally, we propose a pseudo-feature method for cases where the upstream and downstream feature sets differ, a tabular-specific problem widespread in real-world applications. Our code is available at https://github.com/LevinRoman/tabular-transfer-learning .  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

Pruning neural networks reduces inference time and memory costs. On standard hardware, these benefits will be especially prominent if coarse-grained structures, like feature maps, are pruned. We devise two novel saliency-based methods for second-order structured pruning (SOSP) which include correlations among all structures and layers. Our main method SOSP-H employs an innovative second-order approximation, which enables saliency evaluations by fast Hessian-vector products. SOSP-H thereby scales like a first-order method despite taking into account the full Hessian. We validate SOSP-H by comparing it to our second method SOSP-I that uses a well-established Hessian approximation, and to numerous state-of-the-art methods. While SOSP-H performs on par or better in terms of accuracy, it has clear advantages in terms of scalability and efficiency. This allowed us to scale SOSP-H to large-scale vision tasks, even though it captures correlations across all layers of the network. To underscore the global nature of our pruning methods, we evaluate their performance not only by removing structures from a pretrained network, but also by detecting architectural bottlenecks. We show that our algorithms allow to systematically reveal architectural bottlenecks, which we then remove to further increase the accuracy of the networks.  ( 3 min )

Automated decision support systems that are able to infer second opinions from experts can potentially facilitate a more efficient allocation of resources; they can help decide when and from whom to seek a second opinion. In this paper, we look at the design of this type of support systems from the perspective of counterfactual inference. We focus on a multiclass classification setting and first show that, if experts make predictions on their own, the underlying causal mechanism generating their predictions needs to satisfy a desirable set invariant property. Further, we show that, for any causal mechanism satisfying this property, there exists an equivalent mechanism where the predictions by each expert are generated by independent sub-mechanisms governed by a common noise. This motivates the design of a set invariant Gumbel-Max structural causal model where the structure of the noise governing the sub-mechanisms underpinning the model depends on an intuitive notion of similarity between experts which can be estimated from data. Experiments on both synthetic and real data show that our model can be used to infer second opinions more accurately than its non-causal counterpart.  ( 2 min )

We study two problems related to recovering causal graphs from interventional data: (i) $\textit{verification}$, where the task is to check if a purported causal graph is correct, and (ii) $\textit{search}$, where the task is to recover the correct causal graph. For both, we wish to minimize the number of interventions performed. For the first problem, we give a characterization of a minimal sized set of atomic interventions that is necessary and sufficient to check the correctness of a claimed causal graph. Our characterization uses the notion of $\textit{covered edges}$, which enables us to obtain simple proofs and also easily reason about earlier results. We also generalize our results to the settings of bounded size interventions and node-dependent interventional costs. For all the above settings, we provide the first known provable algorithms for efficiently computing (near)-optimal verifying sets on general graphs. For the second problem, we give a simple adaptive algorithm based on graph separators that produces an atomic intervention set which fully orients any essential graph while using $\mathcal{O}(\log n)$ times the optimal number of interventions needed to $\textit{verify}$ (verifying size) the underlying DAG on $n$ vertices. This approximation is tight as $\textit{any}$ search algorithm on an essential line graph has worst case approximation ratio of $\Omega(\log n)$ with respect to the verifying size. With bounded size interventions, each of size $\leq k$, our algorithm gives an $\mathcal{O}(\log n \cdot \log \log k)$ factor approximation. Our result is the first known algorithm that gives a non-trivial approximation guarantee to the verifying size on general unweighted graphs and with bounded size interventions.  ( 3 min )

There has been a massive increase in research interest towards applying data driven methods to problems in mechanics. While traditional machine learning (ML) methods have enabled many breakthroughs, they rely on the assumption that the training (observed) data and testing (unseen) data are independent and identically distributed (i.i.d). Thus, traditional ML approaches often break down when applied to real world mechanics problems with unknown test environments and data distribution shifts. In contrast, out-of-distribution (OOD) generalization assumes that the test data may shift (i.e., violate the i.i.d. assumption). To date, multiple methods have been proposed to improve the OOD generalization of ML methods. However, because of the lack of benchmark datasets for OOD regression problems, the efficiency of these OOD methods on regression problems, which dominate the mechanics field, remains unknown. To address this, we investigate the performance of OOD generalization methods for regression problems in mechanics. Specifically, we identify three OOD problems: covariate shift, mechanism shift, and sampling bias. For each problem, we create two benchmark examples that extend the Mechanical MNIST dataset collection, and we investigate the performance of popular OOD generalization methods on these mechanics-specific regression problems. Our numerical experiments show that in most cases, while the OOD generalization algorithms perform better compared to traditional ML methods on these OOD problems, there is a compelling need to develop more robust OOD generalization methods that are effective across multiple OOD scenarios. Overall, we expect that this study, as well as the associated open access benchmark datasets, will enable further development of OOD generalization methods for mechanics specific regression problems.  ( 3 min )

The expressive and computationally inexpensive bipartite Graph Neural Networks (GNN) have been shown to be an important component of deep learning based Mixed-Integer Linear Program (MILP) solvers. Recent works have demonstrated the effectiveness of such GNNs in replacing the branching (variable selection) heuristic in branch-and-bound (B&B) solvers. These GNNs are trained, offline and on a collection of MILPs, to imitate a very good but computationally expensive branching heuristic, strong branching. Given that B&B results in a tree of sub-MILPs, we ask (a) whether there are strong dependencies exhibited by the target heuristic among the neighboring nodes of the B&B tree, and (b) if so, whether we can incorporate them in our training procedure. Specifically, we find that with the strong branching heuristic, a child node's best choice was often the parent's second-best choice. We call this the "lookback" phenomenon. Surprisingly, the typical branching GNN of Gasse et al. (2019) often misses this simple "answer". To imitate the target behavior more closely by incorporating the lookback phenomenon in GNNs, we propose two methods: (a) target smoothing for the standard cross-entropy loss function, and (b) adding a Parent-as-Target (PAT) Lookback regularizer term. Finally, we propose a model selection framework to incorporate harder-to-formulate objectives such as solving time in the final models. Through extensive experimentation on standard benchmark instances, we show that our proposal results in up to 22% decrease in the size of the B&B tree and up to 15% improvement in the solving times.  ( 3 min )

Electromyography signals can be used as training data by machine learning models to classify various gestures. We seek to produce a model that can classify six different hand gestures with a limited number of samples that generalizes well to a wider audience while comparing the effect of our feature extraction results on model accuracy to other more conventional methods such as the use of AR parameters on a sliding window across the channels of a signal. We appeal to a set of more elementary methods such as the use of random bounds on a signal, but desire to show the power these methods can carry in an online setting where EMG classification is being conducted, as opposed to more complicated methods such as the use of the Fourier Transform. To augment our limited training data, we used a standard technique, known as jitter, where random noise is added to each observation in a channel wise manner. Once all datasets were produced using the above methods, we performed a grid search with Random Forest and XGBoost to ultimately create a high accuracy model. For human computer interface purposes, high accuracy classification of EMG signals is of particular importance to their functioning and given the difficulty and cost of amassing any sort of biomedical data in a high volume, it is valuable to have techniques that can work with a low amount of high-quality samples with less expensive feature extraction methods that can reliably be carried out in an online application.  ( 3 min )

We consider the task of meta-analysis in high-dimensional settings in which the data sources are similar but non-identical. To borrow strength across such heterogeneous datasets, we introduce a global parameter that emphasizes interpretability and statistical efficiency in the presence of heterogeneity. We also propose a one-shot estimator of the global parameter that preserves the anonymity of the data sources and converges at a rate that depends on the size of the combined dataset. For high-dimensional linear model settings, we demonstrate the superiority of our identification restrictions in adapting to a previously seen data distribution as well as predicting for a new/unseen data distribution. Finally, we demonstrate the benefits of our approach on a large-scale drug treatment dataset involving several different cancer cell-lines.  ( 2 min )

Finding equilibria points in continuous minimax games has become a key problem within machine learning, in part due to its connection to the training of generative adversarial networks. Because of existence and robustness issues, recent developments have shifted from pure equilibria to focusing on mixed equilibria points. In this note we consider a method proposed by Domingo-Enrich et al. for finding mixed equilibria in two-layer zero-sum games. The method is based on entropic regularisation and the two competing strategies are represented by two sets of interacting particles. We show that the sequence of empirical measures of the particle system satisfies a large deviation principle as the number of particles grows to infinity, and how this implies convergence of the empirical measure and the associated Nikaid\^o-Isoda error, complementing existing law of large numbers results.  ( 2 min )

We propose a novel anomaly detection method for echocardiogram videos. The introduced method takes advantage of the periodic nature of the heart cycle to learn different variants of a variational latent trajectory model (TVAE). The models are trained on the healthy samples of an in-house dataset of infant echocardiogram videos consisting of multiple chamber views to learn a normative prior of the healthy population. During inference, maximum a posteriori (MAP) based anomaly detection is performed to detect out-of-distribution samples in our dataset. The proposed method reliably identifies severe congenital heart defects, such as Ebstein's Anomaly or Shonecomplex. Moreover, it achieves superior performance over MAP-based anomaly detection with standard variational autoencoders on the task of detecting pulmonary hypertension and right ventricular dilation. Finally, we demonstrate that the proposed method provides interpretable explanations of its output through heatmaps which highlight the regions corresponding to anomalous heart structures.  ( 2 min )

This work discusses how to derive upper bounds for the expected generalisation error of supervised learning algorithms by means of the chaining technique. By developing a general theoretical framework, we establish a duality between generalisation bounds based on the regularity of the loss function, and their chained counterparts, which can be obtained by lifting the regularity assumption from the loss onto its gradient. This allows us to re-derive the chaining mutual information bound from the literature, and to obtain novel chained information-theoretic generalisation bounds, based on the Wasserstein distance and other probability metrics. We show on some toy examples that the chained generalisation bound can be significantly tighter than its standard counterpart, particularly when the distribution of the hypotheses selected by the algorithm is very concentrated. Keywords: Generalisation bounds; Chaining; Information-theoretic bounds; Mutual information; Wasserstein distance; PAC-Bayes.  ( 2 min )

We assess the demand effects of discounts on train tickets issued by the Swiss Federal Railways, the so-called `supersaver tickets', based on machine learning, a subfield of artificial intelligence. Considering a survey-based sample of buyers of supersaver tickets, we investigate which customer- or trip-related characteristics (including the discount rate) predict buying behavior, namely: booking a trip otherwise not realized by train, buying a first- rather than second-class ticket, or rescheduling a trip (e.g.\ away from rush hours) when being offered a supersaver ticket. Predictive machine learning suggests that customer's age, demand-related information for a specific connection (like departure time and utilization), and the discount level permit forecasting buying behavior to a certain extent. Furthermore, we use causal machine learning to assess the impact of the discount rate on rescheduling a trip, which seems relevant in the light of capacity constraints at rush hours. Assuming that (i) the discount rate is quasi-random conditional on our rich set of characteristics and (ii) the buying decision increases weakly monotonically in the discount rate, we identify the discount rate's effect among `always buyers', who would have traveled even without a discount, based on our survey that asks about customer behavior in the absence of discounts. We find that on average, increasing the discount rate by one percentage point increases the share of rescheduled trips by 0.16 percentage points among always buyers. Investigating effect heterogeneity across observables suggests that the effects are higher for leisure travelers and during peak hours when controlling several other characteristics.  ( 3 min )

Online influence maximization aims to maximize the influence spread of a content in a social network with unknown network model by selecting a few seed nodes. Recent studies followed a non-adaptive setting, where the seed nodes are selected before the start of the diffusion process and network parameters are updated when the diffusion stops. We consider an adaptive version of content-dependent online influence maximization problem where the seed nodes are sequentially activated based on real-time feedback. In this paper, we formulate the problem as an infinite-horizon discounted MDP under a linear diffusion process and present a model-based reinforcement learning solution. Our algorithm maintains a network model estimate and selects seed users adaptively, exploring the social network while improving the optimal policy optimistically. We establish $\widetilde O(\sqrt{T})$ regret bound for our algorithm. Empirical evaluations on synthetic network demonstrate the efficiency of our algorithm.  ( 2 min )

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.  ( 3 min )

Model selection in contextual bandits is an important complementary problem to regret minimization with respect to a fixed model class. We consider the simplest non-trivial instance of model-selection: distinguishing a simple multi-armed bandit problem from a linear contextual bandit problem. Even in this instance, current state-of-the-art methods explore in a suboptimal manner and require strong "feature-diversity" conditions. In this paper, we introduce new algorithms that a) explore in a data-adaptive manner, and b) provide model selection guarantees of the form $\mathcal{O}(d^{\alpha} T^{1- \alpha})$ with no feature diversity conditions whatsoever, where $d$ denotes the dimension of the linear model and $T$ denotes the total number of rounds. The first algorithm enjoys a "best-of-both-worlds" property, recovering two prior results that hold under distinct distributional assumptions, simultaneously. The second removes distributional assumptions altogether, expanding the scope for tractable model selection. Our approach extends to model selection among nested linear contextual bandits under some additional assumptions.  ( 2 min )

Procrastination, the irrational delay of tasks, is a common occurrence in online learning. Potential negative consequences include higher risk of drop-outs, increased stress, and reduced mood. Due to the rise of learning management systems and learning analytics, indicators of such behavior can be detected, enabling predictions of future procrastination and other dilatory behavior. However, research focusing on such predictions is scarce. Moreover, studies involving different types of predictors and comparisons between the predictive performance of various methods are virtually non-existent. In this study, we aim to fill these research gaps by analyzing the performance of multiple machine learning algorithms when predicting the delayed or timely submission of online assignments in a higher education setting with two categories of predictors: subjective, questionnaire-based variables and objective, log-data based indicators extracted from a learning management system. The results show that models with objective predictors consistently outperform models with subjective predictors, and a combination of both variable types perform slightly better. For each of these three options, a different approach prevailed (Gradient Boosting Machines for the subjective, Bayesian multilevel models for the objective, and Random Forest for the combined predictors). We conclude that careful attention should be paid to the selection of predictors and algorithms before implementing such models in learning management systems.  ( 3 min )

The loss surface of an overparameterized neural network (NN) possesses many global minima of zero training error. We explain how common variants of the standard NN training procedure change the minimizer obtained. First, we make explicit how the size of the initialization of a strongly overparameterized NN affects the minimizer and can deteriorate its final test performance. We propose a strategy to limit this effect. Then, we demonstrate that for adaptive optimization such as AdaGrad, the obtained minimizer generally differs from the gradient descent (GD) minimizer. This adaptive minimizer is changed further by stochastic mini-batch training, even though in the non-adaptive case, GD and stochastic GD result in essentially the same minimizer. Lastly, we explain that these effects remain relevant for less overparameterized NNs. While overparameterization has its benefits, our work highlights that it induces sources of error absent from underparameterized models.  ( 2 min )

In this work we study the problem of Subspace Tracking with missing data (ST-miss) and outliers (Robust ST-miss). We propose a novel algorithm, and provide a guarantee for both these problems. Unlike past work on this topic, the current work does not impose the piecewise constant subspace change assumption. Additionally, the proposed algorithm is much simpler (uses fewer parameters) than our previous work. Secondly, we extend our approach and its analysis to provably solving these problems when the data is federated and when the over-air data communication modality is used for information exchange between the $K$ peer nodes and the center. We validate our theoretical claims with extensive numerical experiments.  ( 2 min )

Wasserstein GANs with Gradient Penalty (WGAN-GP) are a very popular method for training generative models to produce high quality synthetic data. While WGAN-GP were initially developed to calculate the Wasserstein 1 distance between generated and real data, recent works (e.g. [23]) have provided empirical evidence that this does not occur, and have argued that WGAN-GP perform well not in spite of this issue, but because of it. In this paper we show for the first time that WGAN-GP compute the minimum of a different optimal transport problem, the so-called congested transport [7]. Congested transport determines the cost of moving one distribution to another under a transport model that penalizes congestion. For WGAN-GP, we find that the congestion penalty has a spatially varying component determined by the sampling strategy used in [12] which acts like a local speed limit, making congestion cost less in some regions than others. This aspect of the congested transport problem is new, in that the congestion penalty turns out to be unbounded and depends on the distributions to be transported, and so we provide the necessary mathematical proofs for this setting. One facet of our discovery is a formula connecting the gradient of solutions to the optimization problem in WGAN-GP to the time averaged momentum of the optimal mass flow. This is in contrast to the gradient of Kantorovich potentials for the Wasserstein 1 distance, which is just the normalized direction of flow. Based on this and other considerations, we speculate on how our results explain the observed performance of WGAN-GP. Beyond applications to GANs, our theorems also point to the possibility of approximately solving large scale congested transport problems using neural network techniques.  ( 3 min )

K-FAC is a successful tractable implementation of Natural Gradient for Deep Learning, which nevertheless suffers from the requirement to compute the inverse of the Kronecker factors (through an eigen-decomposition). This can be very time-consuming (or even prohibitive) when these factors are large. In this paper, we theoretically show that, owing to the exponential-average construction paradigm of the Kronecker factors that is typically used, their eigen-spectrum must decay. We show numerically that in practice this decay is very rapid, leading to the idea that we could save substantial computation by only focusing on the first few eigen-modes when inverting the Kronecker-factors. Randomized Numerical Linear Algebra provides us with the necessary tools to do so. Numerical results show we obtain $\approx2.5\times$ reduction in per-epoch time and $\approx3.3\times$ reduction in time to target accuracy. We compare our proposed K-FAC sped-up versions with a more computationally efficient NG implementation, SENG, and observe we perform on par with it.  ( 2 min )

We study the problem of model selection in bandit scenarios in the presence of nested policy classes, with the goal of obtaining simultaneous adversarial and stochastic ("best of both worlds") high-probability regret guarantees. Our approach requires that each base learner comes with a candidate regret bound that may or may not hold, while our meta algorithm plays each base learner according to a schedule that keeps the base learner's candidate regret bounds balanced until they are detected to violate their guarantees. We develop careful mis-specification tests specifically designed to blend the above model selection criterion with the ability to leverage the (potentially benign) nature of the environment. We recover the model selection guarantees of the CORRAL algorithm for adversarial environments, but with the additional benefit of achieving high probability regret bounds, specifically in the case of nested adversarial linear bandits. More importantly, our model selection results also hold simultaneously in stochastic environments under gap assumptions. These are the first theoretical results that achieve best of both world (stochastic and adversarial) guarantees while performing model selection in (linear) bandit scenarios.  ( 2 min )

Learning nonparametric systems of Ordinary Differential Equations (ODEs) $\dot x = f(t,x)$ from noisy and sparse data is an emerging machine learning topic. We use the well-developed theory of Reproducing Kernel Hilbert Spaces (RKHS) to define candidates for $f$ for which the solution of the ODE exists and is unique. Learning $f$ consists of solving a constrained optimization problem in an RKHS. We propose a penalty method that iteratively uses the Representer theorem and Euler approximations to provide a numerical solution. We prove a generalization bound for the $L^2$ distance between $x$ and its estimator. Experiments are provided for the FitzHugh Nagumo oscillator and for the prediction of the Amyloid level in the cortex of aging subjects. In both cases, we show competitive results when compared with the state of the art.  ( 2 min )

One of the major concerns of targeting interventions on individuals in social welfare programs is discrimination: individualized treatments may induce disparities across sensitive attributes such as age, gender, or race. This paper addresses the question of the design of fair and efficient treatment allocation rules. We adopt the non-maleficence perspective of first do no harm: we select the fairest allocation within the Pareto frontier. We cast the optimization into a mixed-integer linear program formulation, which can be solved using off-the-shelf algorithms. We derive regret bounds on the unfairness of the estimated policy function and small sample guarantees on the Pareto frontier under general notions of fairness. Finally, we illustrate our method using an application from education economics.  ( 2 min )

I was reading something this afternoon and ran across φ(φ(m)) and thought that was unusual. I often run across φ(m), the number of positive integers less than m and relative prime to m, but don’t often see Euler’s phi function iterated. Application of φ∘φ This section will give an example of a theorem where φ(φ(m)) […] Phi Phi first appeared on John D. Cook.  ( 5 min )

I am writing a research paper, and in it I use a proprietary ML model I made. I want to show the model's results and I can explain how it works, but I don't want to explicitly provide the model/its code. Is that commonplace in research papers or must I include specifics to show validity? submitted by /u/Typical-Ad-7443 [link] [comments]  ( 87 min )

Hello. I have built a dataset that contains results of experiments I have been doing over some physical materials. Each row contains summary data for each piece, like width, height, weight, etc. Then I have several columns which values are arrays. Each one of these columns contain a list of tuples, for example (162636363, 1373.8377). The first number is a timestamp, the second one the magnitude of a force applied to the material (or, for instance, the position where the force was applied, contact duration, etc.). We have hundreds or even thousands of tuples on each column. So, all columns represent measurements of the experiments done to a particular material. We are recording when the material is damaged, since we want to predict its lifetime when the material is exposed to repetitive forces. I'm wondering what to do with those array values. One option is to sort the tuples lists by timestamp and then treat the readings as a vector of a predefined dimension. But I have never fed this kind of data to a boosted tree model/framework like XGBoost. The only experience I had feeding long vectors to a model was when doing some NLP, in that case the vectors were representations of words. Do you think a vector made of all my experiments over a material can be treated as an embedding in a way? If so, how is the recommended way to proceed with this data in the modeling stage? Time series perhaps? I'd appreciate your ideas and comments. Thanks!! submitted by /u/iblysa [link] [comments]  ( 87 min )

So I've read up on ViT, and while it's an impressive architecture, I seem to notice that they are using a [class] token to get the actual class from an input image (see image below). ​ Architecture of ViT While I know that it's standard to use an extra token in this fashion, since the encoder spits out one embedding for every input token (or patch in this case), I was wondering why don't we simply concatenate all the embeddings before feeding them into the MLP head (of an appropriate size)? ​ It seems to me like we are discarding a lot of information here, that could be helpful in the classification task. It's true, in theory, that the attention should take care of that, but do you know of any papers where this concatenation strategy has been tried? Does it even make sense? ​ Cheers! submitted by /u/MurlocXYZ [link] [comments]  ( 87 min )

Hi, very long time lurker here. I'm planning to propose an end to end architecture for my daughter's sake. Data is biomedical and any CNN is well capable of classfying if over %95 Acc (easy data u know!). However, I need to come up with an acronym to fit my daughter's name. Her name is DURU and here is what I come up with: D- Deep (Deep like you know, deep learning) U-Unified (I may use multiple models to form up an ensemble or feature concat, which will make it unified) R- Residual (I may use residual connections between Cnn blocks. Though not flashy right now.) R- Recommender (Could use recommender keyword, since I'm putting down sort of a Computer Aided Diagnosis Framework thingy) R- Another R thing is welcome. U - I need another U and I'm totally out of words. Three letters is all I came up with. Couldn't find a word for the 4th letter that makes sense. U-net? I'm not segmentating anything. But if it was a segmentation dataset I may have come up with DUR-UNet which would make sense. I need a final keyword starting with U which is applicable with CNNs. It could be minor trick to cope with overfitting, a loss function, an activation function, etc. It could also be a filler term like Unified. Hope we could come up with a solution. submitted by /u/cltexe [link] [comments]  ( 87 min )

I am very excited to share our latest research: Causal inference in the scenario of an energy-efficient building design to answer "what-if" questions during the design process. Abs: "What-if" questions are intuitively generated and commonly asked during the design process. Engineers and architects need to inherently conduct design decisions, progressing from one phase to another. They either use empirical domain experience, simulations, or data-driven methods to provide consequential feedback. We take an example from an interdisciplinary domain of energy-efficient building design to argue that the current methods for decision support have four limitations: 1. Less carefully inspected parametric independence raises the risks of biased results and spurious relationships. 2. The integration …  ( 88 min )

I am using dlib.get_frontal_face_detector() And fir large images (several mb) it takes a lot of time to detect a face. What are the ways to increase speed of face detection, without sacrificing accuracy? I cannot use gpu/cuda sadly... submitted by /u/glorsh66 [link] [comments]  ( 86 min )

Generally actor critic algorithms have 1 Neural net giving 1 of each via a linear layer - to give a policy and to give the value. But humans change decisions and how they think based on their mood. I wanted to incorporate this into a standard actor critic like A2C/A3C. I wanted to add another actor in this architecture that represented a certain mood, where it's objective was not to maximize the reward but something else that I have in mind. I don't see any such literature in the field and I don't know how to add more actors. Is it not possible to have multiple actors with one critic ? Has this been passed on by the community for a lack of potential ? submitted by /u/darthsocker [link] [comments]  ( 87 min )

Upgini is a simple feature search & enrichment library in Python. With Upgini, you spend less time for external data search and feature engineering, which will be done for you automatically. Just use your labeled dataset to initiate search through thousands of features and data sources, including public datasets and scraped data shared by Data science community. Only the relevant features that improve prediction power of your ML model are returned. Motivation: for most supervised ML models external data & features boost accuracy significantly better than any hyperparameters tuning. But lack of automated and time-efficient search tools for external data blocks massive adoption of external features in ML pipelines.We want radically simplify features search and delivery for ML pipelines to make external data a standard approach. Like a hyperparameter tuning for machine learning nowadays. Mission: Democratize access to data sources for data science community. 📊 Data coverage and statistics Total: 239 countries and up to 41 years of history https://preview.redd.it/oj87fnkw9s891.png?width=1220&format=png&auto=webp&s=4195a607addca12d400bc4b0b62307ac4db87b67 More info about the library To install Upgini from PyPI run pip install -U upgini Full release notes: https://github.com/upgini/upgini Try the online demo at Colab. submitted by /u/AnnualLimp1418 [link] [comments]  ( 87 min )

The new release of a fast and flexible library for image augmentation includes: New augmentations: UnsharpMask sharpens the input image using Unsharp Masking processing and overlays the result with the original image. PixelDropout randomly replaces pixels with the passed value. https://preview.redd.it/ic1nm7mw3s891.png?width=942&format=png&auto=webp&s=c95e319f26a19bad42d33fd84e0ef27703db9095 RingingOvershoot creates ringing or overshoot artifacts by convolving the image with a 2D sinc filter. AdvancedBlur blurs the input image using a Generalized Normal filter with randomly selected parameters. It also adds multiplicative noise to generated kernel before convolution. https://preview.redd.it/wb1v6vyw3s891.png?width=941&format=png&auto=webp&s=2e57ae1b583b7aab7c30125058a25ee296afd2bd Improvements and bug fixes Fixed all np.random use cases to prevent identical values when using multiprocessing. Also, we fixed corner cases and made improvements for many augmentations. Release notes Full release notes are available at https://github.com/albumentations-team/albumentations/releases/tag/1.2.0 Installation As always, you can install the latest version of the library by running: pip install -U albumentations submitted by /u/alexparinov [link] [comments]  ( 87 min )

I am curious to hear what you usually use to develop interactive versions of your research models! And, if you have any, I'd be excited to see some examples for inspiration 😊. On that note, about 2 weeks ago, I shared an article on developing a Super-Resolution GAN Research Demo in Lightning on r/MachineLearning: Bottom-up look at the new Lightning Framework for building anything from production-ready ML systems to research demos Running research demos locally is not super useful by itself (unless you maybe do that live at a poster session -- I still have painful memories of doing that with privacy GAN demo in Flask), so this is a follow-up article on deploying the App on the Cloud: Sharing Deep Learning Research Models with Lightning Part 2: Leveraging the Cloud. Also, curious to hear what you think! submitted by /u/seraschka [link] [comments]  ( 88 min )

Hello Everyone! My name is Derek, and I am a co-chair for the Workshop on AI for Strategy Games at AIIDE this year. I wanted to share some info about the workshop for those that may be interested in discussing the future of AI for strategy games or looking to publish/get feedback on any work research you are doing with strategy games. Feel free to message me if you have any questions! Workshop website: https://skatgame.net/mburo/aiide22ws/ Submission deadline: July 29, 2022 Topics This workshop welcomes original research contributions, position papers, competition AI system descriptions, and post-mortem game analyses in the area of AI for strategy games --- including modern video strategy games (such as FPS and RTS games), and turn based games and puzzles. Topics include, but are not r…  ( 89 min )

Curious about the usage of the word "large" in the research community and in papers as a descriptor. About 3 years ago, Bert-Large was considered large at 345 million parameters. Today we have a 11-B parameter T-5 model and larger. When describing models in papers, is there consensus as to what we consider a "large" model or set of categories to describe models based on their size? submitted by /u/certain_entropy [link] [comments]  ( 88 min )

When I say "SOTA" I'm talking about recent architectures like ViT, BERT, GPT-like models.. Is it possible to train any of these from scratch (no pre-trained checkpoint) with low resources (Colab, Colab pro) ? submitted by /u/Silver_Doughnut_8175 [link] [comments]  ( 91 min )

Hello members, soo my question is suppose we have a model or architecture at we have an image classifier at the end of it which is trained on mnist images. We need to train the model such that when the image is passed through the classifier it outcomes it's results with some uncertainty in its predictions. We need to use that uncertainty in order to develop a loss function to train the whole model as we can't use the true labels of the images. Any resources or ideas related to above which can be helpful pls share with me. Any suggestions will be appreciated. Thanks submitted by /u/Anonymous_Guy_12 [link] [comments]  ( 86 min )

Hi guys, I am dealing with 1000s of devices distributed over the whole world. These devices log and upload events (e.g. various kinds of device faults) including a time stamp to a database. My tasks now is to analyze these time series of events, detect anomalies and then automatically send notifications about these anomalies. Anomalies I want to detect may include things like: - sudden spikes in the number of events - sudden changes of the type of events - long term drift of the number of events - etc. etc. Any advice on suitable algorithms for this kind of problems and/or according literature would be highly appreciated. Thanks! 👍 submitted by /u/RafiRafiRafiRafi [link] [comments]  ( 93 min )

Hey guys, working on an AES project. Just wanted to know if there exists an AES system that can be trained on languages like Swahili, Arabic, Hindi etc. Languages having almost no AES studies done. Would be very helpful of you to guide me through, any other tips/pointers towards this task are much appreciated, would love it if someone can point me in the right direction. submitted by /u/NeoKoseii [link] [comments]  ( 86 min )

I am very excited to share our latest research: a new framework RankSEG on (image) segmentation. Abs: In this paper, we establish a theoretical foundation of segmentation with respect to the Dice/IoU metrics, including the Bayes rule and Dice/IoU-calibration, analogous to classification-calibration or Fisher consistency in classification. We prove that the existing thresholding-based framework with most operating losses are NOT consistent with respect to the Dice/IoU metrics, and thus may lead to a suboptimal solution. To address this pitfall, we propose a novel consistent ranking-based framework, namely RankDice/RankIoU, inspired by plug-in rules of the Bayes segmentation rule. Three numerical algorithms with GPU parallel execution are developed to implement the proposed framework in lar…  ( 88 min )

We already have architecture(s) which are supposed to fix one of the biggest issues with transformers, namely that they scale quadratically with input size. The performer scales linearly, which should allow for much bigger context windows, yet looking at recent large language models from major players, all of them seem to be using the old transformer save for some minor improvements. The only exception was Flamingo which had to use a Perceiver because images are huge. So why haven't we ditched the transformer yet? submitted by /u/DickMan64 [link] [comments]  ( 92 min )

Anomalib is Machine Library developed by AI researchers from Intel which implements state of the art algorithms for anomaly detection. Anomaly detection is popular use case in the industrial sector and such algorithms can help provide real-time feedback to manufactures on how well their production lines are performing. Anomaly Detection is a challenging problem often due to a biased dataset. Anomalous images can be scare therefore these algorithms are trained on good images in an unsupervised fashion. By learning the normality, upon inference, the models can detect whether images are anomalous or not. Anomalib was built using a PyTorchLightning Backbone and offers an easy way to deploy the models with OpenVino for inference speedup. Link to the github repo: https://github.com/openvinotoolkit/anomalib Link to a tutorial on how to train your custom dataset with anomalib: https://github.com/openvinotoolkit/anomalib/tree/development/docs/blog/001-train-custom-dataset Please feel free to check out the repo and give us your feedback submitted by /u/alder-ice [link] [comments]  ( 87 min )

I think the answer to this question depends on heavily on the area at hand. That is why I am asking here, even though this question has been asked elsewhere a gazillion times. How much does your advisor help/contribute? How often do you meet? I am especially interested in people who have published papers. Who proposed the problem, and then found a solution? how much of that solution was joint work vs either of you submitting ideas to the other and being approved or rejected? how satisfied/dissatisfied do you feel with respect to your advisor? have you had multiple advisors? if so, how do they compare? Let me start by sharing my experience. I always take the initiative when organizing a meeting with my advisor; if I don't say anything, we probably wouldn't meet. I send him biweekly emails with my progress. Usually this entails a write-up explaining my ideas and their development. I think he skims through it, but he definitely does not read it carefully/go through the details. When we have a meeting I generally have to explain the content of the write-up. In terms of the content itself, he tells me whether the ideas/problem seem sound or not, but does not propose improvements. Sometimes, he proposes other ideas that would imply a significant shift of my current work, which honestly I tend to reject because I have already invested a great deal of time to my ideas and I am more emotionally attached to them (I know this latter point isn't good practice). Overall, I don't know how to feel because I don't really know what's generally expected. If I had to chose, however, I'd say I feel mildly satisfied. What's your experience? submitted by /u/carlml [link] [comments]  ( 100 min )

Does anyone know if there exists a NLP model, like Lambda, that takes every conversation attempts to update their weights in order to incorporate it into its training? My thought process would be instead of using attention and a subsection of the conversation to generate a response, it takes everything. Basically everything gets back propagated and adjusts the weights. This way the model might begin to "remember" its previous conversations. This may be a stretch and perhaps I am missing something fundamental, but it seems like an interesting experiment. I'd love to continue this conversation and elaborate more in the comments. submitted by /u/gabe415160 [link] [comments]  ( 84 min )

Hey all, This is a question I've been asking myself lately; what are the fields of ML which show the most promise in helping mankind in non-frivolous ways (e.g. not animojis)? A few years ago I remember an article describing how one of Microsoft's object detection services helped give 'sight' to the blind by describing what's in the room around them through its computer vision. Another one that I found inspiring was about assisting those with locked-in-syndrome by mapping their brain waves and/or eye movement to certain images, words or letters (I forget which). submitted by /u/lituga [link] [comments]  ( 84 min )

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Then you would have a whole new book, which is better to read. ​ Wouldn't that also pass the copyright from the author to the developer of the AI? ​ 2 Question: Is there an AI that really has a realistic voice, which you can use to make audio books? submitted by /u/xXNOdrugsForMEXx [link] [comments]  ( 85 min )

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I was just reading the research paper "Computing machinery and Intelligence", a paper that Alan Turing had published in 1950, and I did not quite understand a section of the paper where he wrote about the parameters of the machine to be considered in the "imitation game". It would be of great help if anyone could explain these parameters , especially the third parameter. ​ https://preview.redd.it/0bcnothvzr891.png?width=630&format=png&auto=webp&s=ddee792f5c451568bc73c368c0c14c8bd09597e4 submitted by /u/Huckleberry-4915 [link] [comments]  ( 87 min )

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I know there's one or two options for real-time voice changing that don't sound so convincing (that is, they sound robotic). I was wondering if there's anything that might sound better but doesn't operate in real time? I plan on voicing male and female characters in a video and I have plenty of time to edit the voice clips together but I need them to sound convincing. Free stuff is preferred but I'd consider paying money if that's the only way to get good results. submitted by /u/outsm0ked [link] [comments]  ( 86 min )

Hello Everyone! My name is Derek, and I am a co-chair for the Workshop on AI for Strategy Games at AIIDE this year. I wanted to share some info about the workshop for those that may be interested in discussing the future of AI for strategy games or looking to publish/get feedback on any work research you are doing with strategy games. Feel free to message me if you have any questions! Workshop website: https://skatgame.net/mburo/aiide22ws/ Submission deadline: July 29, 2022 Topics This workshop welcomes original research contributions, position papers, competition AI system descriptions, and post-mortem game analyses in the area of AI for strategy games --- including modern video strategy games (such as FPS and RTS games), and turn based games and puzzles. Topics include, but are not r…  ( 87 min )

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In Sutton's book, page 63, there is this proof/statement: ​ ​ https://preview.redd.it/azjnvai76r891.png?width=711&format=png&auto=webp&s=ecc4f276a986e07247a769ec4d9df4a9d68da194 Can anyone explain or point out some reference that explains: Why is that v*(s) = max q(s,a)? How can I get Eq (3.18)? Thank you! submitted by /u/rlopes404 [link] [comments]  ( 86 min )

Hi, I am using the MPE (https://github.com/openai/multiagent-particle-envs) and I'm planning to use a visual observation. I was wondering, what size should it be? I assume that if it is too large and the agents are only a few, I am wasting lots of compute for nothing and also the noise becomes a lot. But how to find the best size? 60x60x3 for example? submitted by /u/No_Possibility_7588 [link] [comments]  ( 85 min )

Posted by Dan Walker and Dan Liebling, Software Engineers, Google Research People don’t write in the same way that they speak. Written language is controlled and deliberate, whereas transcripts of spontaneous speech (like interviews) are hard to read because speech is disorganized and less fluent. One aspect that makes speech transcripts particularly difficult to read is disfluency, which includes self-corrections, repetitions, and filled pauses (e.g., words like “umm”, and “you know”). Following is an example of a spoken sentence with disfluencies from the LDC CALLHOME corpus: But that's it's not, it's not, it's, uh, it's a word play on what you just said. It takes some time to understand this sentence — the listener must filter out the extraneous words and resolve all of the nots. Remo…  ( 27 min )

Posted by Ethan Dyer and Guy Gur-Ari, Research Scientists, Google Research, Blueshift Team Language models have demonstrated remarkable performance on a variety of natural language tasks — indeed, a general lesson from many works, including BERT, GPT-3, Gopher, and PaLM, has been that neural networks trained on diverse data at large scale in an unsupervised way can perform well on a variety of tasks. Quantitative reasoning is one area in which language models still fall far short of human-level performance. Solving mathematical and scientific questions requires a combination of skills, including correctly parsing a question with natural language and mathematical notation, recalling relevant formulas and constants, and generating step-by-step solutions involving numerical calculations and…  ( 25 min )

I wrote this article for machine learning and analytic professionals in general. Actually, I describe a new visual, simple, intuitive method for supervised classification. It involves synthetic data and explainable AI. But at the same time, I describe in layman’s terms the Riemann Hypothesis (RH). Also, I offer a new perspective on the subject for… Read More »The Riemann Hypothesis in One Picture The post The Riemann Hypothesis in One Picture appeared first on Data Science Central.  ( 21 min )

You can access Amazon SageMaker Studio notebooks from the Amazon SageMaker console via AWS Identity and Access Management (IAM) authenticated federation from your identity provider (IdP), such as Okta. When a Studio user opens the notebook link, Studio validates the federated user’s IAM policy to authorize access, and generates and resolves the presigned URL for […]  ( 6 min )

In part 1 of this series, we demonstrated how to resolve an Amazon SageMaker Studio presigned URL from a corporate network using Amazon private VPC endpoints without traversing the internet. In this post, we will continue to build on top of the previous solution to demonstrate how to build a private API Gateway via Amazon API […]  ( 7 min )

Some things are easy as A, B, C. But when it comes to autonomous vehicles, the key may be in one, two, three. Faction, a Bay Area-based startup and NVIDIA Inception member, is preparing to debut its business-to-business autonomous delivery service, accelerating its commercial deployment with three-wheel production electric vehicles purpose-built for driverless services. In Read article > The post Three Wheeling: Startup Faction Develops Affordable Tri-Wheel AVs on NVIDIA DRIVE appeared first on NVIDIA Blog.  ( 5 min )

Turn the TV on. GeForce NOW is leveling up gaming in the living room. The Samsung Gaming Hub launched today, delivering GeForce NOW natively on 2022 Samsung Smart TVs. Plus, the SHIELD Software Experience Upgrade 9.1 is now rolling out to all NVIDIA SHIELD TVs, delivering new gaming features that improve GeForce NOW. Great living Read article > The post The Gaming Evolution Will Be Televised: GFN Thursday Levels Up the Living Room Experience on New Samsung TVs and More appeared first on NVIDIA Blog.  ( 8 min )

The SI prefixes giga and tera were adopted in 1960. The prefixes eta and peta were adopted in 1975, and zetta and yotta were adopted in 1991. Following this 15-year cadence, we should have adopted a few more prefixes by now. If we ever do introduce new prefixes, what might they be? The latest prefixes […] Speculation on new SI prefixes first appeared on John D. Cook.  ( 5 min )

Blog post miniseries summarizing byteLAKE’s recommendation about hardware platforms to perform CFD Suite’s AI Training at the Edge.  ( 15 min )

FIGS (Fast Interpretable Greedy-tree Sums): A method for building interpretable models by simultaneously growing an ensemble of decision trees in competition with one another. Recent machine-learning advances have led to increasingly complex predictive models, often at the cost of interpretability. We often need interpretability, particularly in high-stakes applications such as in clinical decision-making; interpretable models help with all kinds of things, such as identifying errors, leveraging domain knowledge, and making speedy predictions. In this blog post we’ll cover FIGS, a new method for fitting an interpretable model that takes the form of a sum of trees. Real-world experiments and theoretical results show that FIGS can effectively adapt to a wide range of structure in data, ach…  ( 3 min )

I have a dataset with 7 input features and 1 output.The length of the dataset is just 260, which is small. How can I train a neural network with the help of keras and achieve accuracy of over 80%? What should be the architecture of the deep neural network? submitted by /u/mono1110 [link] [comments]  ( 85 min )

Researchers develop tools to help data scientists make the features used in machine-learning models more understandable for end users.  ( 7 min )

In this paper we establish a bridge between Topological Data Analysis and Geometric Deep Learning, adapting the topological theory of group equivariant non-expansive operators (GENEOs) to act on the space of all graphs weighted on vertices or edges. This is done by showing how the general concept of GENEO can be used to transform graphs and to give information about their structure. This requires the introduction of the new concepts of generalized permutant and generalized permutant measure and the mathematical proof that these concepts allow us to build GENEOs between graphs. An experimental section concludes the paper, illustrating the possible use of our operators to extract information from graphs. This paper is part of a line of research devoted to developing a compositional and geometric theory of GENEOs for Geometric Deep Learning.  ( 2 min )

In contemporary popular music production, drum sound design is commonly performed by cumbersome browsing and processing of pre-recorded samples in sound libraries. One can also use specialized synthesis hardware, typically controlled through low-level, musically meaningless parameters. Today, the field of Deep Learning offers methods to control the synthesis process via learned high-level features and allows generating a wide variety of sounds. In this paper, we present DrumGAN VST, a plugin for synthesizing drum sounds using a Generative Adversarial Network. DrumGAN VST operates on 44.1 kHz sample-rate audio, offers independent and continuous instrument class controls, and features an encoding neural network that maps sounds into the GAN's latent space, enabling resynthesis and manipulation of pre-existing drum sounds. We provide numerous sound examples and a demo of the proposed VST plugin.  ( 2 min )

Privacy and interpretability are two of the important ingredients for achieving trustworthy machine learning. We study the interplay of these two aspects in graph machine learning through graph reconstruction attacks. The goal of the adversary here is to reconstruct the graph structure of the training data given access to model explanations. Based on the different kinds of auxiliary information available to the adversary, we propose several graph reconstruction attacks. We show that additional knowledge of post-hoc feature explanations substantially increases the success rate of these attacks. Further, we investigate in detail the differences between attack performance with respect to three different classes of explanation methods for graph neural networks: gradient-based, perturbation-based, and surrogate model-based methods. While gradient-based explanations reveal the most in terms of the graph structure, we find that these explanations do not always score high in utility. For the other two classes of explanations, privacy leakage increases with an increase in explanation utility. Finally, we propose a defense based on a randomized response mechanism for releasing the explanations which substantially reduces the attack success rate. Our anonymized code is available.  ( 2 min )

Monocular depth is important in many tasks, such as 3D reconstruction and autonomous driving. Deep learning based models achieve state-of-the-art performance in this field. A set of novel approaches for estimating monocular depth consists of transforming the regression task into a classification one. However, there is a lack of detailed descriptions and comparisons for Classification Approaches for Regression (CAR) in the community and no in-depth exploration of their potential for uncertainty estimation. To this end, this paper will introduce a taxonomy and summary of CAR approaches, a new uncertainty estimation solution for CAR, and a set of experiments on depth accuracy and uncertainty quantification for CAR-based models on KITTI dataset. The experiments reflect the differences in the portability of various CAR methods on two backbones. Meanwhile, the newly proposed method for uncertainty estimation can outperform the ensembling method with only one forward propagation.

Human limb motion tracking and recognition plays an important role in medical rehabilitation training, lower limb assistance, prosthetics design for amputees, feedback control for assistive robots, etc. Lightweight wearable sensors, including inertial sensors, surface electromyography sensors, and flexible strain/pressure, are promising to become the next-generation human motion capture devices. Herein, we present a wireless wearable device consisting of a sixteen-channel flexible sponge-based pressure sensor array to recognize various human lower limb motions by detecting contours on the human skin caused by calf gastrocnemius muscle actions. Each sensing element is a round porous structure of thin carbon nanotube/polydimethylsiloxane nanocomposites with a diameter of 4 mm and thickness of about 400 {\mu}m. Ten human subjects were recruited to perform ten different lower limb motions while wearing the developed device. The motion classification result with the support vector machine method shows a macro-recall of about 97.3% for all ten motions tested. This work demonstrates a portable wearable muscle activity detection device with a lower limb motion recognition application, which can be potentially used in assistive robot control, healthcare, sports monitoring, etc.

We propose a message passing algorithm, based on variational Bayesian inference, for low-rank tensor completion with automatic rank determination in the canonical polyadic format when additional side information (SI) is given. The SI comes in the form of low-dimensional subspaces the contain the fiber spans of the tensor (columns, rows, tubes, etc.). We validate the regularization properties induced by SI with extensive numerical experiments on synthetic and real-world data and present the results about tensor recovery and rank determination. The results show that the number of samples required for successful completion is significantly reduced in the presence of SI. We also discuss the origin of a bump in the phase transition curves that exists when the dimensionality of SI is comparable with that of the tensor.

We develop the first fast spectral algorithm to decompose a random third-order tensor over $\mathbb{R}^d$ of rank up to $O(d^{3/2}/\text{polylog}(d))$. Our algorithm only involves simple linear algebra operations and can recover all components in time $O(d^{6.05})$ under the current matrix multiplication time. Prior to this work, comparable guarantees could only be achieved via sum-of-squares [Ma, Shi, Steurer 2016]. In contrast, fast algorithms [Hopkins, Schramm, Shi, Steurer 2016] could only decompose tensors of rank at most $O(d^{4/3}/\text{polylog}(d))$. Our algorithmic result rests on two key ingredients. A clean lifting of the third-order tensor to a sixth-order tensor, which can be expressed in the language of tensor networks. A careful decomposition of the tensor network into a sequence of rectangular matrix multiplications, which allows us to have a fast implementation of the algorithm.

Molecular dynamics (MD) simulation is the workhorse of various scientific domains but is limited by high computational cost. Learning-based force fields have made major progress in accelerating ab-initio MD simulation but are still not fast enough for many real-world applications that require long-time MD simulation. In this paper, we adopt a different machine learning approach where we coarse-grain a physical system using graph clustering, and model the system evolution with a very large time-integration step using graph neural networks. A novel score-based GNN refinement module resolves the long-standing challenge of long-time simulation instability. Despite only trained with short MD trajectory data, our learned simulator can generalize to unseen novel systems and simulate for much longer than the training trajectories. Properties requiring 10-100 ns level long-time dynamics can be accurately recovered at several-orders-of-magnitude higher speed than classical force fields. We demonstrate the effectiveness of our method on two realistic complex systems: (1) single-chain coarse-grained polymers in implicit solvent; (2) multi-component Li-ion polymer electrolyte systems.

Generating multi-contrasts/modal MRI of the same anatomy enriches diagnostic information but is limited in practice due to excessive data acquisition time. In this paper, we propose a novel deep-learning model for joint reconstruction and synthesis of multi-modal MRI using incomplete k-space data of several source modalities as inputs. The output of our model includes reconstructed images of the source modalities and high-quality image synthesized in the target modality. Our proposed model is formulated as a variational problem that leverages several learnable modality-specific feature extractors and a multimodal synthesis module. We propose a learnable optimization algorithm to solve this model, which induces a multi-phase network whose parameters can be trained using multi-modal MRI data. Moreover, a bilevel-optimization framework is employed for robust parameter training. We demonstrate the effectiveness of our approach using extensive numerical experiments.

Lipschitz learning is a graph-based semi-supervised learning method where one extends labels from a labeled to an unlabeled data set by solving the infinity Laplace equation on a weighted graph. In this work we prove uniform convergence rates for solutions of the graph infinity Laplace equation as the number of vertices grows to infinity. Their continuum limits are absolutely minimizing Lipschitz extensions with respect to the geodesic metric of the domain where the graph vertices are sampled from. We work under very general assumptions on the graph weights, the set of labeled vertices, and the continuum domain. Our main contribution is that we obtain quantitative convergence rates even for very sparsely connected graphs, as they typically appear in applications like semi-supervised learning. In particular, our framework allows for graph bandwidths down to the connectivity radius. For proving this we first show a quantitative convergence statement for graph distance functions to geodesic distance functions in the continuum. Using the "comparison with distance functions" principle, we can pass these convergence statements to infinity harmonic functions and absolutely minimizing Lipschitz extensions.

When training neural networks with simulated quantization, we observe that quantized weights can, rather unexpectedly, oscillate between two grid-points. The importance of this effect and its impact on quantization-aware training (QAT) are not well-understood or investigated in literature. In this paper, we delve deeper into the phenomenon of weight oscillations and show that it can lead to a significant accuracy degradation due to wrongly estimated batch-normalization statistics during inference and increased noise during training. These effects are particularly pronounced in low-bit ($\leq$ 4-bits) quantization of efficient networks with depth-wise separable layers, such as MobileNets and EfficientNets. In our analysis we investigate several previously proposed QAT algorithms and show that most of these are unable to overcome oscillations. Finally, we propose two novel QAT algorithms to overcome oscillations during training: oscillation dampening and iterative weight freezing. We demonstrate that our algorithms achieve state-of-the-art accuracy for low-bit (3 & 4 bits) weight and activation quantization of efficient architectures, such as MobileNetV2, MobileNetV3, and EfficentNet-lite on ImageNet. Our source code is available at {https://github.com/qualcomm-ai-research/oscillations-qat}.

Optimal transport is a framework for comparing measures whereby a cost is incurred for transporting one measure to another. Recent works have aimed to improve optimal transport plans through the introduction of various forms of structure. We introduce novel order constraints into the optimal transport formulation to allow for the incorporation of structure. We define an efficient method for obtaining explainable solutions to the new formulation that scales far better than standard approaches. The theoretical properties of the method are provided. We demonstrate experimentally that order constraints improve explainability using the e-SNLI (Stanford Natural Language Inference) dataset that includes human-annotated rationales as well as on several image color transfer examples.

Algorithms and models are increasingly deployed to inform decisions about people, inevitably affecting their lives. As a consequence, those in charge of developing these models must carefully evaluate their impact on different groups of people and favour group fairness, that is, ensure that groups determined by sensitive demographic attributes, such as race or sex, are not treated unjustly. To achieve this goal, the availability (awareness) of these demographic attributes to those evaluating the impact of these models is fundamental. Unfortunately, collecting and storing these attributes is often in conflict with industry practices and legislation on data minimisation and privacy. For this reason, it can be hard to measure the group fairness of trained models, even from within the companies developing them. In this work, we tackle the problem of measuring group fairness under unawareness of sensitive attributes, by using techniques from quantification, a supervised learning task concerned with directly providing group-level prevalence estimates (rather than individual-level class labels). We show that quantification approaches are particularly suited to tackle the fairness-under-unawareness problem, as they are robust to inevitable distribution shifts while at the same time decoupling the (desirable) objective of measuring group fairness from the (undesirable) side effect of allowing the inference of sensitive attributes of individuals. More in detail, we show that fairness under unawareness can be cast as a quantification problem and solved with proven methods from the quantification literature. We show that these methods outperform previous approaches to measure demographic parity in five experimental protocols, corresponding to important challenges that complicate the estimation of classifier fairness under unawareness.

In Bayesian structure learning, we are interested in inferring a distribution over the directed acyclic graph (DAG) structure of Bayesian networks, from data. Defining such a distribution is very challenging, due to the combinatorially large sample space, and approximations based on MCMC are often required. Recently, a novel class of probabilistic models, called Generative Flow Networks (GFlowNets), have been introduced as a general framework for generative modeling of discrete and composite objects, such as graphs. In this work, we propose to use a GFlowNet as an alternative to MCMC for approximating the posterior distribution over the structure of Bayesian networks, given a dataset of observations. Generating a sample DAG from this approximate distribution is viewed as a sequential decision problem, where the graph is constructed one edge at a time, based on learned transition probabilities. Through evaluation on both simulated and real data, we show that our approach, called DAG-GFlowNet, provides an accurate approximation of the posterior over DAGs, and it compares favorably against other methods based on MCMC or variational inference.

Recurrent State-space models (RSSMs) are highly expressive models for learning patterns in time series data and system identification. However, these models assume that the dynamics are fixed and unchanging, which is rarely the case in real-world scenarios. Many control applications often exhibit tasks with similar but not identical dynamics which can be modeled as a latent variable. We introduce the Hidden Parameter Recurrent State Space Models (HiP-RSSMs), a framework that parametrizes a family of related dynamical systems with a low-dimensional set of latent factors. We present a simple and effective way of learning and performing inference over this Gaussian graphical model that avoids approximations like variational inference. We show that HiP-RSSMs outperforms RSSMs and competing multi-task models on several challenging robotic benchmarks both on real-world systems and simulations.

Image-to-image translation (i2i) networks suffer from entanglement effects in presence of physics-related phenomena in target domain (such as occlusions, fog, etc), lowering altogether the translation quality, controllability and variability. In this paper, we build upon collection of simple physics models and present a comprehensive method for disentangling visual traits in target images, guiding the process with a physical model that renders some of the target traits, and learning the remaining ones. Because it allows explicit and interpretable outputs, our physical models (optimally regressed on target) allows generating unseen scenarios in a controllable manner. We also extend our framework, showing versatility to neural-guided disentanglement. The results show our disentanglement strategies dramatically increase performances qualitatively and quantitatively in several challenging scenarios for image translation.

Motivated by the state-of-art psychological research, we note that a piano performance transcribed with existing Automatic Music Transcription (AMT) methods cannot be successfully resynthesized without affecting the artistic content of the performance. This is due to 1) the different mappings between MIDI parameters used by different instruments, and 2) the fact that musicians adapt their way of playing to the surrounding acoustic environment. To face this issue, we propose a methodology to build acoustics-specific AMT systems that are able to model the adaptations that musicians apply to convey their interpretation. Specifically, we train models tailored for virtual instruments in a modular architecture that takes as input an audio recording and the relative aligned music score, and outputs the acoustics-specific velocities of each note. We test different model shapes and show that the proposed methodology generally outperforms the usual AMT pipeline which does not consider specificities of the instrument and of the acoustic environment. Interestingly, such a methodology is extensible in a straightforward way since only slight efforts are required to train models for the inference of other piano parameters, such as pedaling.

The R\'{e}nyi cross-entropy measure between two distributions, a generalization of the Shannon cross-entropy, was recently used as a loss function for the improved design of deep learning generative adversarial networks. In this work, we examine the properties of this measure and derive closed-form expressions for it when one of the distributions is fixed and when both distributions belong to the exponential family. We also analytically determine a formula for the cross-entropy rate for stationary Gaussian processes and for finite-alphabet Markov sources.  ( 2 min )

Security analysts prepare threat analysis upon investigating an attack, an emerging cyber threat, or a recently discovered vulnerability. Threat intelligence on malware attacks and campaigns is shared on blog posts, reports, analyses, and tweets with varying technical details. Other security analysts use this intelligence to inform them of emerging threats, indicators of compromise, attack methods, and preventative measures. Collectively known as threat intelligence, it is typically in an unstructured format and, therefore, challenging to integrate seamlessly into existing IDPS systems. In this paper, we propose a framework that aggregates and combines CTI - the openly available cyber threat intelligence information. The information is extracted and stored in a structured format using knowledge graphs such that the semantics of the threat intelligence can be preserved and shared at scale with other security analysts. We propose the first semi-supervised open-source knowledge graph (KG) framework, TINKER, to capture cyber threat information and its context. Following TINKER, we generate a Cyberthreat Intelligence Knowledge Graph (CTI-KG). We demonstrate the efficacy of CTI-KG using different use cases and its application for security analysts.

While the real world application of reinforcement learning (RL) is becoming popular, the safety concern and the robustness of an RL system require more attention. A recent work reveals that, in a multi-agent RL environment, backdoor trigger actions can be injected into a victim agent (a.k.a. trojan agent), which can result in a catastrophic failure as soon as it sees the backdoor trigger action. We propose the problem of RL Backdoor Detection, aiming to address this safety vulnerability. An interesting observation we drew from extensive empirical studies is a trigger smoothness property where normal actions similar to the backdoor trigger actions can also trigger low performance of the trojan agent. Inspired by this observation, we propose a reinforcement learning solution TrojanSeeker to find approximate trigger actions for the trojan agents, and further propose an efficient approach to mitigate the trojan agents based on machine unlearning. Experiments show that our approach can correctly distinguish and mitigate all the trojan agents across various types of agents and environments.

Optimal transport (OT) theory describes general principles to define and select, among many possible choices, the most efficient way to map a probability measure onto another. That theory has been mostly used to estimate, given a pair of source and target probability measures $(\mu,\nu)$, a parameterized map $T_\theta$ that can efficiently map $\mu$ onto $\nu$. In many applications, such as predicting cell responses to treatments, the data measures $\mu,\nu$ (features of untreated/treated cells) that define optimal transport problems do not arise in isolation but are associated with a context $c$ (the treatment). To account for and incorporate that context in OT estimation, we introduce CondOT, an approach to estimate OT maps conditioned on a context variable, using several pairs of measures $(\mu_i, \nu_i)$ tagged with a context label $c_i$. Our goal is to % extract from a dataset of labeled pairs $\{(c_i, (\mu_i, \nu_i))\}$ learn a global map $\mathcal{T}_{\theta}$ which is not only expected to fit em all pairs in the dataset $\{(c_i, (\mu_i, \nu_i))\}$, i.e., $\mathcal{T}_{\theta}(c_i) \sharp\mu_i \approx \nu_i$, but should generalize to produce meaningful maps $\mathcal{T}_{\theta}(c_{\text{new}})$ conditioned on unseen contexts $c_{\text{new}}$. Our approach harnesses and provides a novel usage for partially input convex neural networks, for which we introduce a robust and efficient initialization strategy inspired by Gaussian approximations. We demonstrate the ability of CondOT to infer the effect of an arbitrary combination of genetic or therapeutic perturbations on single cells, using only observations of the effects of said perturbations separately.  ( 3 min )

Rapid developments of quantum information technology show promising opportunities for simulating quantum field theory in near-term quantum devices. In this work, we formulate the theory of (time-dependent) variational quantum simulation of the 1+1 dimensional $\lambda \phi^4$ quantum field theory including encoding, state preparation, and time evolution, with several numerical simulation results. These algorithms could be understood as near-term variational analogs of the Jordan-Lee-Preskill algorithm, the basic algorithm for simulating quantum field theory using universal quantum devices. Besides, we highlight the advantages of encoding with harmonic oscillator basis based on the LSZ reduction formula and several computational efficiency such as when implementing a bosonic version of the unitary coupled cluster ansatz to prepare initial states. We also discuss how to circumvent the "spectral crowding" problem in the quantum field theory simulation and appraise our algorithm by both state and subspace fidelities.

In learning from label proportions (LLP), the instances are grouped into bags, and the task is to learn an instance classifier given relative class proportions in training bags. LLP is useful when obtaining individual instance labels is impossible or costly. In this work, we focus on the case of small bags, which allows to design an algorithm that explicitly considers all consistent instance label combinations. In particular, we propose an EM algorithm alternating between optimizing a general neural network instance classifier and incorporating bag-level annotations. Using two different image datasets, we experimentally compare this method with an approach based on normal approximation and two existing LLP methods. The results show that our approach converges faster to a comparable or better solution.

Unsupervised detection of anomaly points in time series is a challenging problem, which requires the model to derive a distinguishable criterion. Previous methods tackle the problem mainly through learning pointwise representation or pairwise association, however, neither is sufficient to reason about the intricate dynamics. Recently, Transformers have shown great power in unified modeling of pointwise representation and pairwise association, and we find that the self-attention weight distribution of each time point can embody rich association with the whole series. Our key observation is that due to the rarity of anomalies, it is extremely difficult to build nontrivial associations from abnormal points to the whole series, thereby, the anomalies' associations shall mainly concentrate on their adjacent time points. This adjacent-concentration bias implies an association-based criterion inherently distinguishable between normal and abnormal points, which we highlight through the \emph{Association Discrepancy}. Technically, we propose the \emph{Anomaly Transformer} with a new \emph{Anomaly-Attention} mechanism to compute the association discrepancy. A minimax strategy is devised to amplify the normal-abnormal distinguishability of the association discrepancy. The Anomaly Transformer achieves state-of-the-art results on six unsupervised time series anomaly detection benchmarks of three applications: service monitoring, space & earth exploration, and water treatment.

Coreset selection, which aims to select a subset of the most informative training samples, is a long-standing learning problem that can benefit many downstream tasks such as data-efficient learning, continual learning, neural architecture search, active learning, etc. However, many existing coreset selection methods are not designed for deep learning, which may have high complexity and poor generalization performance. In addition, the recently proposed methods are evaluated on models, datasets, and settings of different complexities. To advance the research of coreset selection in deep learning, we contribute a comprehensive code library, namely DeepCore, and provide an empirical study on popular coreset selection methods on CIFAR10 and ImageNet datasets. Extensive experiments on CIFAR10 and ImageNet datasets verify that, although various methods have advantages in certain experiment settings, random selection is still a strong baseline.

Out-of-distribution (OOD) detection is important for machine learning models deployed in the wild. Recent methods use auxiliary outlier data to regularize the model for improved OOD detection. However, these approaches make a strong distributional assumption that the auxiliary outlier data is completely separable from the in-distribution (ID) data. In this paper, we propose a novel framework that leverages wild mixture data, which naturally consists of both ID and OOD samples. Such wild data is abundant and arises freely upon deploying a machine learning classifier in their natural habitats. Our key idea is to formulate a constrained optimization problem and to show how to tractably solve it. Our learning objective maximizes the OOD detection rate, subject to constraints on the classification error of ID data and on the OOD error rate of ID examples. We extensively evaluate our approach on common OOD detection tasks and demonstrate superior performance.

Reinforcement learning algorithms require many samples when solving complex hierarchical tasks with sparse and delayed rewards. For such complex tasks, the recently proposed RUDDER uses reward redistribution to leverage steps in the Q-function that are associated with accomplishing sub-tasks. However, often only few episodes with high rewards are available as demonstrations since current exploration strategies cannot discover them in reasonable time. In this work, we introduce Align-RUDDER, which utilizes a profile model for reward redistribution that is obtained from multiple sequence alignment of demonstrations. Consequently, Align-RUDDER employs reward redistribution effectively and, thereby, drastically improves learning on few demonstrations. Align-RUDDER outperforms competitors on complex artificial tasks with delayed rewards and few demonstrations. On the Minecraft ObtainDiamond task, Align-RUDDER is able to mine a diamond, though not frequently. Code is available at https://github.com/ml-jku/align-rudder. YouTube: https://youtu.be/HO-_8ZUl-UY

We study GPT-3, a recent large language model, using tools from cognitive psychology. More specifically, we assess GPT-3's decision-making, information search, deliberation, and causal reasoning abilities on a battery of canonical experiments from the literature. We find that much of GPT-3's behavior is impressive: it solves vignette-based tasks similarly or better than human subjects, is able to make decent decisions from descriptions, outperforms humans in a multi-armed bandit task, and shows signatures of model-based reinforcement learning. Yet we also find that small perturbations to vignette-based tasks can lead GPT-3 vastly astray, that it shows no signatures of directed exploration, and that it fails miserably in a causal reasoning task. These results enrich our understanding of current large language models and pave the way for future investigations using tools from cognitive psychology to study increasingly capable and opaque artificial agents.  ( 2 min )

Modeling continuous dynamical systems from discretely sampled observations is a fundamental problem in data science. Often, such dynamics are the result of non-local processes that present an integral over time. As such, these systems are modeled with Integro-Differential Equations (IDEs); generalizations of differential equations that comprise both an integral and a differential component. For example, brain dynamics are not accurately modeled by differential equations since their behavior is non-Markovian, i.e. dynamics are in part dictated by history. Here, we introduce the Neural IDE (NIDE), a framework that models ordinary and integral components of IDEs using neural networks. We test NIDE on several toy and brain activity datasets and demonstrate that NIDE outperforms other models, including Neural ODE. These tasks include time extrapolation as well as predicting dynamics from unseen initial conditions, which we test on whole-cortex activity recordings in freely behaving mice. Further, we show that NIDE can decompose dynamics into its Markovian and non-Markovian constituents, via the learned integral operator, which we test on fMRI brain activity recordings of people on ketamine. Finally, the integrand of the integral operator provides a latent space that gives insight into the underlying dynamics, which we demonstrate on wide-field brain imaging recordings. Altogether, NIDE is a novel approach that enables modeling of complex non-local dynamics with neural networks.  ( 3 min )

Heterogeneous tabular data are the most commonly used form of data and are essential for numerous critical and computationally demanding applications. On homogeneous data sets, deep neural networks have repeatedly shown excellent performance and have therefore been widely adopted. However, their adaptation to tabular data for inference or data generation tasks remains challenging. To facilitate further progress in the field, this work provides an overview of state-of-the-art deep learning methods for tabular data. We categorize these methods into three groups: data transformations, specialized architectures, and regularization models. For each of these groups, our work offers a comprehensive overview of the main approaches. Moreover, we discuss deep learning approaches for generating tabular data, and we also provide an overview over strategies for explaining deep models on tabular data. Thus, our first contribution is to address the main research streams and existing methodologies in the mentioned areas, while highlighting relevant challenges and open research questions. Our second contribution is to provide an empirical comparison of traditional machine learning methods with eleven deep learning approaches across five popular real-world tabular data sets of different sizes and with different learning objectives. Our results, which we have made publicly available as competitive benchmarks, indicate that algorithms based on gradient-boosted tree ensembles still mostly outperform deep learning models on supervised learning tasks, suggesting that the research progress on competitive deep learning models for tabular data is stagnating. To the best of our knowledge, this is the first in-depth overview of deep learning approaches for tabular data; as such, this work can serve as a valuable starting point to guide researchers and practitioners interested in deep learning with tabular data.

For the highly imbalanced credit card fraud detection problem, most existing methods either use data augmentation methods or conventional machine learning models, while neural network-based anomaly detection approaches are lacking. Furthermore, few studies have employed AI interpretability tools to investigate the feature importance of transaction data, which is crucial for the black-box fraud detection module. Considering these two points together, we propose a novel anomaly detection framework for credit card fraud detection as well as a model-explaining module responsible for prediction explanations. The fraud detection model is composed of two deep neural networks, which are trained in an unsupervised and adversarial manner. Precisely, the generator is an AutoEncoder aiming to reconstruct genuine transaction data, while the discriminator is a fully-connected network for fraud detection. The explanation module has three white-box explainers in charge of interpretations of the AutoEncoder, discriminator, and the whole detection model, respectively. Experimental results show the state-of-the-art performances of our fraud detection model on the benchmark dataset compared with baselines. In addition, prediction analyses by three explainers are presented, offering a clear perspective on how each feature of an instance of interest contributes to the final model output.

The acoustic environment can degrade speech quality during communication (e.g., video call, remote presentation, outside voice recording), and its impact is often unknown. Objective metrics for speech quality have proven challenging to develop given the multi-dimensionality of factors that affect speech quality and the difficulty of collecting labeled data. Hypothesizing the impact of acoustics on speech quality, this paper presents MOSRA: a non-intrusive multi-dimensional speech quality metric that can predict room acoustics parameters (SNR, STI, T60, DRR, and C50) alongside the overall mean opinion score (MOS) for speech quality. By explicitly optimizing the model to learn these room acoustics parameters, we can extract more informative features and improve the generalization for the MOS task when the training data is limited. Furthermore, we also show that this joint training method enhances the blind estimation of room acoustics, improving the performance of current state-of-the-art models. An additional side-effect of this joint prediction is the improvement in the explainability of the predictions, which is a valuable feature for many applications.  ( 2 min )

Medical report generation task, which targets to produce long and coherent descriptions of medical images, has attracted growing research interests recently. Different from the general image captioning tasks, medical report generation is more challenging for data-driven neural models. This is mainly due to 1) the serious data bias and 2) the limited medical data. To alleviate the data bias and make best use of available data, we propose a Competence-based Multimodal Curriculum Learning framework (CMCL). Specifically, CMCL simulates the learning process of radiologists and optimizes the model in a step by step manner. Firstly, CMCL estimates the difficulty of each training instance and evaluates the competence of current model; Secondly, CMCL selects the most suitable batch of training instances considering current model competence. By iterating above two steps, CMCL can gradually improve the model's performance. The experiments on the public IU-Xray and MIMIC-CXR datasets show that CMCL can be incorporated into existing models to improve their performance.  ( 2 min )

With the fast development of quantum computing and deep learning, quantum neural networks have attracted great attention recently. By leveraging the power of quantum computing, deep neural networks can potentially overcome computational power limitations in classic machine learning. However, when multiple quantum machines wish to train a global model using the local data on each machine, it may be very difficult to copy the data into one machine and train the model. Therefore, a collaborative quantum neural network framework is necessary. In this article, we borrow the core idea of federated learning to propose QuantumFed, a quantum federated learning framework to have multiple quantum nodes with local quantum data train a mode together. Our experiments show the feasibility and robustness of our framework.

In this work, we study the possibility of defending against data-poisoning attacks while training a shallow neural network in a regression setup. We focus on doing supervised learning for a class of depth-2 finite-width neural networks, which includes single-filter convolutional networks. In this class of networks, we attempt to learn the network weights in the presence of a malicious oracle doing stochastic, bounded and additive adversarial distortions on the true output during training. For the non-gradient stochastic algorithm that we construct, we prove worst-case near-optimal trade-offs among the magnitude of the adversarial attack, the weight approximation accuracy, and the confidence achieved by the proposed algorithm. As our algorithm uses mini-batching, we analyze how the mini-batch size affects convergence. We also show how to utilize the scaling of the outer layer weights to counter output-poisoning attacks depending on the probability of attack. Lastly, we give experimental evidence demonstrating how our algorithm outperforms stochastic gradient descent under different input data distributions, including instances of heavy-tailed distributions.

The challenge in the widely applicable online matching problem lies in making irrevocable assignments while there is uncertainty about future inputs. Most theoretically-grounded policies are myopic or greedy in nature. In real-world applications where the matching process is repeated on a regular basis, the underlying data distribution can be leveraged for better decision-making. We present an end-to-end Reinforcement Learning framework for deriving better matching policies based on trial-and-error on historical data. We devise a set of neural network architectures, design feature representations, and empirically evaluate them across two online matching problems: Edge-Weighted Online Bipartite Matching and Online Submodular Bipartite Matching. We show that most of the learning approaches perform consistently better than classical baseline algorithms on four synthetic and real-world datasets. On average, our proposed models improve the matching quality by 3-10% on a variety of synthetic and real-world datasets. Our code is publicly available at https://github.com/lyeskhalil/CORL.

Physics-informed neural networks (PINNs) have become a popular choice for solving high-dimensional partial differential equations (PDEs) due to their excellent approximation power and generalization ability. Recently, Extended PINNs (XPINNs) based on domain decomposition methods have attracted considerable attention due to their effectiveness in modeling multiscale and multiphysics problems and their parallelization. However, theoretical understanding on their convergence and generalization properties remains unexplored. In this study, we take an initial step towards understanding how and when XPINNs outperform PINNs. Specifically, for general multi-layer PINNs and XPINNs, we first provide a prior generalization bound via the complexity of the target functions in the PDE problem, and a posterior generalization bound via the posterior matrix norms of the networks after optimization. Moreover, based on our bounds, we analyze the conditions under which XPINNs improve generalization. Concretely, our theory shows that the key building block of XPINN, namely the domain decomposition, introduces a tradeoff for generalization. On the one hand, XPINNs decompose the complex PDE solution into several simple parts, which decreases the complexity needed to learn each part and boosts generalization. On the other hand, decomposition leads to less training data being available in each subdomain, and hence such model is typically prone to overfitting and may become less generalizable. Empirically, we choose five PDEs to show when XPINNs perform better than, similar to, or worse than PINNs, hence demonstrating and justifying our new theory.

We approach the task of network congestion control in datacenters using Reinforcement Learning (RL). Successful congestion control algorithms can dramatically improve latency and overall network throughput. Until today, no such learning-based algorithms have shown practical potential in this domain. Evidently, the most popular recent deployments rely on rule-based heuristics that are tested on a predetermined set of benchmarks. Consequently, these heuristics do not generalize well to newly-seen scenarios. Contrarily, we devise an RL-based algorithm with the aim of generalizing to different configurations of real-world datacenter networks. We overcome challenges such as partial-observability, non-stationarity, and multi-objectiveness. We further propose a policy gradient algorithm that leverages the analytical structure of the reward function to approximate its derivative and improve stability. We show that this scheme outperforms alternative popular RL approaches, and generalizes to scenarios that were not seen during training. Our experiments, conducted on a realistic simulator that emulates communication networks' behavior, exhibit improved performance concurrently on the multiple considered metrics compared to the popular algorithms deployed today in real datacenters. Our algorithm is being productized to replace heuristics in some of the largest datacenters in the world.

CoMoGAN is a continuous GAN relying on the unsupervised reorganization of the target data on a functional manifold. To that matter, we introduce a new Functional Instance Normalization layer and residual mechanism, which together disentangle image content from position on target manifold. We rely on naive physics-inspired models to guide the training while allowing private model/translations features. CoMoGAN can be used with any GAN backbone and allows new types of image translation, such as cyclic image translation like timelapse generation, or detached linear translation. On all datasets, it outperforms the literature. Our code is available at this http URL .

Autoencoders exhibit impressive abilities to embed the data manifold into a low-dimensional latent space, making them a staple of representation learning methods. However, without explicit supervision, which is often unavailable, the representation is usually uninterpretable, making analysis and principled progress challenging. We propose a framework, called latent responses, which exploits the locally contractive behavior exhibited by variational autoencoders to explore the learned manifold. More specifically, we develop tools to probe the representation using interventions in the latent space to quantify the relationships between latent variables. We extend the notion of disentanglement to take the learned generative process into account and consequently avoid the limitations of existing metrics that may rely on spurious correlations. Our analyses underscore the importance of studying the causal structure of the representation to improve performance on downstream tasks such as generation, interpolation, and inference of the factors of variation.

A trained neural network can be interpreted as a structural causal model (SCM) that provides the effect of changing input variables on the model's output. However, if training data contains both causal and correlational relationships, a model that optimizes prediction accuracy may not necessarily learn the true causal relationships between input and output variables. On the other hand, expert users often have prior knowledge of the causal relationship between certain input variables and output from domain knowledge. Therefore, we propose a regularization method that aligns the learned causal effects of a neural network with domain priors, including both direct and total causal effects. We show that this approach can generalize to different kinds of domain priors, including monotonicity of causal effect of an input variable on output or zero causal effect of a variable on output for purposes of fairness. Our experiments on twelve benchmark datasets show its utility in regularizing a neural network model to maintain desired causal effects, without compromising on accuracy. Importantly, we also show that a model thus trained is robust and gets improved accuracy on noisy inputs.

Fetal growth assessment from ultrasound is based on a few biometric measurements that are performed manually and assessed relative to the expected gestational age. Reliable biometry estimation depends on the precise detection of landmarks in standard ultrasound planes. Manual annotation can be time-consuming and operator dependent task, and may results in high measurements variability. Existing methods for automatic fetal biometry rely on initial automatic fetal structure segmentation followed by geometric landmark detection. However, segmentation annotations are time-consuming and may be inaccurate, and landmark detection requires developing measurement-specific geometric methods. This paper describes BiometryNet, an end-to-end landmark regression framework for fetal biometry estimation that overcomes these limitations. It includes a novel Dynamic Orientation Determination (DOD) method for enforcing measurement-specific orientation consistency during network training. DOD reduces variabilities in network training, increases landmark localization accuracy, thus yields accurate and robust biometric measurements. To validate our method, we assembled a dataset of 3,398 ultrasound images from 1,829 subjects acquired in three clinical sites with seven different ultrasound devices. Comparison and cross-validation of three different biometric measurements on two independent datasets shows that BiometryNet is robust and yields accurate measurements whose errors are lower than the clinically permissible errors, outperforming other existing automated biometry estimation methods. Code is available at https://github.com/netanellavisdris/fetalbiometry.  ( 3 min )

We formalize and study the natural approach of designing convex surrogate loss functions via embeddings, for problems such as classification, ranking, or structured prediction. In this approach, one embeds each of the finitely many predictions (e.g. rankings) as a point in $R^d$, assigns the original loss values to these points, and "convexifies" the loss in some way to obtain a surrogate. We establish a strong connection between this approach and polyhedral (piecewise-linear convex) surrogate losses: every discrete loss is embedded by some polyhedral loss, and every polyhedral loss embeds some discrete loss. Moreover, an embedding gives rise to a consistent link function as well as linear surrogate regret bounds. Our results are constructive, as we illustrate with several examples. In particular, our framework gives succinct proofs of consistency or inconsistency for various polyhedral surrogates in the literature, and for inconsistent surrogates, it further reveals the discrete losses for which these surrogates are consistent. We go on to show additional structure of embeddings, such as the equivalence of embedding and matching Bayes risks, and the equivalence of various notions of non-redudancy. Using these results, we establish that indirect elicitation, a necessary condition for consistency, is also sufficient when working with polyhedral surrogates.

Comparison of data representations is a complex multi-aspect problem that has not enjoyed a complete solution yet. We propose a method for comparing two data representations. We introduce the Representation Topology Divergence (RTD), measuring the dissimilarity in multi-scale topology between two point clouds of equal size with a one-to-one correspondence between points. The data point clouds are allowed to lie in different ambient spaces. The RTD is one of the few TDA-based practical methods applicable to real machine learning datasets. Experiments show that the proposed RTD agrees with the intuitive assessment of data representation similarity and is sensitive to its topological structure. We apply RTD to gain insights on neural networks representations in computer vision and NLP domains for various problems: training dynamics analysis, data distribution shift, transfer learning, ensemble learning, disentanglement assessment.

Model-free policy learning has been shown to be capable of learning manipulation policies which can solve long-time horizon tasks using single-step manipulation primitives. However, training these policies is a time-consuming process requiring large amounts of data. We propose the Local Dynamics Model (LDM) which efficiently learns the state-transition function for these manipulation primitives. By combining the LDM with model-free policy learning, we can learn policies which can solve complex manipulation tasks using one-step lookahead planning. We show that the LDM is both more sample-efficient and outperforms other model architectures. When combined with planning, we can outperform other model-based and model-free policies on several challenging manipulation tasks in simulation.

In this work, we study the use of the Bellman equation as a surrogate objective for value prediction accuracy. While the Bellman equation is uniquely solved by the true value function over all state-action pairs, we find that the Bellman error (the difference between both sides of the equation) is a poor proxy for the accuracy of the value function. In particular, we show that (1) due to cancellations from both sides of the Bellman equation, the magnitude of the Bellman error is only weakly related to the distance to the true value function, even when considering all state-action pairs, and (2) in the finite data regime, the Bellman equation can be satisfied exactly by infinitely many suboptimal solutions. This means that the Bellman error can be minimized without improving the accuracy of the value function. We demonstrate these phenomena through a series of propositions, illustrative toy examples, and empirical analysis in standard benchmark domains.

A major source of information can be taken from financial news articles, which have some correlations about the fluctuation of stock trends. In this paper, we investigate the influences of financial news on the stock trends, from a multi-instance view. The intuition behind this is based on the news uncertainty of varying intervals of news occurrences and the lack of annotation in every single financial news. Under the scenario of Multiple Instance Learning (MIL) where training instances are arranged in bags, and a label is assigned for the entire bag instead of instances, we develop a flexible and adaptive multi-instance learning model and evaluate its ability in directional movement forecast of Standard & Poors 500 index on financial news dataset. Specifically, we treat each trading day as one bag, with certain amounts of news happening on each trading day as instances in each bag. Experiment results demonstrate that our proposed multi-instance-based framework gains outstanding results in terms of the accuracy of trend prediction, compared with other state-of-art approaches and baselines.  ( 2 min )

We propose a novel framework to solve risk-sensitive reinforcement learning (RL) problems where the agent optimises time-consistent dynamic spectral risk measures. Based on the notion of conditional elicitability, our methodology constructs (strictly consistent) scoring functions that are used as penalizers in the estimation procedure. Our contribution is threefold: we (i) devise an efficient approach to estimate a class of dynamic spectral risk measures with deep neural networks, (ii) prove that these dynamic spectral risk measures may be approximated to any arbitrary accuracy using deep neural networks, and (iii) develop a risk-sensitive actor-critic algorithm that uses full episodes and does not require any additional nested transitions. We compare our conceptually improved reinforcement learning algorithm with the nested simulation approach and illustrate its performance in two settings: statistical arbitrage and portfolio allocation on both simulated and real data.

Generative models have emerged as an essential building block for many image synthesis and editing tasks. Recent advances in this field have also enabled high-quality 3D or video content to be generated that exhibits either multi-view or temporal consistency. With our work, we explore 4D generative adversarial networks (GANs) that learn unconditional generation of 3D-aware videos. By combining neural implicit representations with time-aware discriminator, we develop a GAN framework that synthesizes 3D video supervised only with monocular videos. We show that our method learns a rich embedding of decomposable 3D structures and motions that enables new visual effects of spatio-temporal renderings while producing imagery with quality comparable to that of existing 3D or video GANs.

Physics simulators have shown great promise for conveniently learning reinforcement learning policies in safe, unconstrained environments. However, transferring the acquired knowledge to the real world can be challenging due to the reality gap. To this end, several methods have been recently proposed to automatically tune simulator parameters with posterior distributions given real data, for use with domain randomization at training time. These approaches have been shown to work for various robotic tasks under different settings and assumptions. Nevertheless, existing literature lacks a thorough comparison of existing adaptive domain randomization methods with respect to transfer performance and real-data efficiency. In this work, we present an open benchmark for both offline and online methods (SimOpt, BayRn, DROID, DROPO), to shed light on which are most suitable for each setting and task at hand. We found that online methods are limited by the quality of the currently learned policy for the next iteration, while offline methods may sometimes fail when replaying trajectories in simulation with open-loop commands. The code used will be released at https://github.com/gabrieletiboni/adr-benchmark.

In this paper, we consider risk-sensitive sequential decision-making in Reinforcement Learning (RL). Our contributions are two-fold. First, we introduce a novel and coherent quantification of risk, namely composite risk, which quantifies the joint effect of aleatory and epistemic risk during the learning process. Existing works considered either aleatory or epistemic risk individually, or as an additive combination. We prove that the additive formulation is a particular case of the composite risk when the epistemic risk measure is replaced with expectation. Thus, the composite risk is more sensitive to both aleatory and epistemic uncertainty than the individual and additive formulations. We also propose an algorithm, SENTINEL-K, based on ensemble bootstrapping and distributional RL for representing epistemic and aleatory uncertainty respectively. The ensemble of K learners uses Follow The Regularised Leader (FTRL) to aggregate the return distributions and obtain the composite risk. We experimentally verify that SENTINEL-K estimates the return distribution better, and while used with composite risk estimates, demonstrates higher risk-sensitive performance than state-of-the-art risk-sensitive and distributional RL algorithms.

We discuss the prediction accuracy of assumed statistical models in terms of prediction errors for the generalized linear model and penalized maximum likelihood methods. We derive the forms of estimators for the prediction errors: $C_p$ criterion, information criteria, and leave-one-out cross validation (LOOCV) error, using the generalized approximate message passing (GAMP) algorithm and replica method. These estimators coincide with each other when the number of model parameters is sufficiently small; however, there is a discrepancy between them in particular in the overparametrized region where the number of model parameters is larger than the data dimension. In this paper, we review the prediction errors and corresponding estimators, and discuss their differences. In the framework of GAMP, we show that the information criteria can be expressed by using the variance of the estimates. Further, we demonstrate how to approach LOOCV error from the information criteria by utilizing the expression provided by GAMP.

We create classical (non-quantum) dynamic data structures supporting queries for recommender systems and least-squares regression that are comparable to their quantum analogues. De-quantizing such algorithms has received a flurry of attention in recent years; we obtain sharper bounds for these problems. More significantly, we achieve these improvements by arguing that the previous quantum-inspired algorithms for these problems are doing leverage or ridge-leverage score sampling in disguise; these are powerful and standard techniques in randomized numerical linear algebra. With this recognition, we are able to employ the large body of work in numerical linear algebra to obtain algorithms for these problems that are simpler or faster (or both) than existing approaches. Our experiments demonstrate that the proposed data structures also work well on real-world datasets.

We develop a framework for comparing data manifolds, aimed, in particular, towards the evaluation of deep generative models. We describe a novel tool, Cross-Barcode(P,Q), that, given a pair of distributions in a high-dimensional space, tracks multiscale topology spacial discrepancies between manifolds on which the distributions are concentrated. Based on the Cross-Barcode, we introduce the Manifold Topology Divergence score (MTop-Divergence) and apply it to assess the performance of deep generative models in various domains: images, 3D-shapes, time-series, and on different datasets: MNIST, Fashion MNIST, SVHN, CIFAR10, FFHQ, chest X-ray images, market stock data, ShapeNet. We demonstrate that the MTop-Divergence accurately detects various degrees of mode-dropping, intra-mode collapse, mode invention, and image disturbance. Our algorithm scales well (essentially linearly) with the increase of the dimension of the ambient high-dimensional space. It is one of the first TDA-based practical methodologies that can be applied universally to datasets of different sizes and dimensions, including the ones on which the most recent GANs in the visual domain are trained. The proposed method is domain agnostic and does not rely on pre-trained networks.

Deep Reinforcement Learning (DRL) uses diverse, unstructured data and makes RL capable of learning complex policies in high dimensional environments. Intelligent Transportation System (ITS) based on Autonomous Vehicles (AVs) offers an excellent playground for policy-based DRL. Deep learning architectures solve computational challenges of traditional algorithms while helping in real-world adoption and deployment of AVs. One of the main challenges in AVs implementation is that it can worsen traffic congestion on roads if not reliably and efficiently managed. Considering each vehicle's holistic effect and using efficient and reliable techniques could genuinely help optimise traffic flow management and congestion reduction. For this purpose, we proposed a intelligent traffic control system that deals with complex traffic congestion scenarios at intersections and behind the intersections. We proposed a DRL-based signal control system that dynamically adjusts traffic signals according to the current congestion situation on intersections. To deal with the congestion on roads behind the intersection, we used re-routing technique to load balance the vehicles on road networks. To achieve the actual benefits of the proposed approach, we break down the data silos and use all the data coming from sensors, detectors, vehicles and roads in combination to achieve sustainable results. We used SUMO micro-simulator for our simulations. The significance of our proposed approach is manifested from the results.

Recent performance breakthroughs in Artificial intelligence (AI) and Machine learning (ML), especially advances in Deep learning (DL), the availability of powerful, easy-to-use ML libraries (e.g., scikit-learn, TensorFlow, PyTorch.), and increasing computational power have led to unprecedented interest in AI/ML among nuclear engineers. For physics-based computational models, Verification, Validation and Uncertainty Quantification (VVUQ) have been very widely investigated and a lot of methodologies have been developed. However, VVUQ of ML models has been relatively less studied, especially in nuclear engineering. In this work, we focus on UQ of ML models as a preliminary step of ML VVUQ, more specifically, Deep Neural Networks (DNNs) because they are the most widely used supervised ML algorithm for both regression and classification tasks. This work aims at quantifying the prediction, or approximation uncertainties of DNNs when they are used as surrogate models for expensive physical models. Three techniques for UQ of DNNs are compared, namely Monte Carlo Dropout (MCD), Deep Ensembles (DE) and Bayesian Neural Networks (BNNs). Two nuclear engineering examples are used to benchmark these methods, (1) time-dependent fission gas release data using the Bison code, and (2) void fraction simulation based on the BFBT benchmark using the TRACE code. It was found that the three methods typically require different DNN architectures and hyperparameters to optimize their performance. The UQ results also depend on the amount of training data available and the nature of the data. Overall, all these three methods can provide reasonable estimations of the approximation uncertainties. The uncertainties are generally smaller when the mean predictions are close to the test data, while the BNN methods usually produce larger uncertainties than MCD and DE.

We present an approach for generating playable games that blend a given set of games in a desired combination using deep generative latent variable models. We refer to this approach as latent combinational game design -- latent since we use learned latent representations to perform blending, combinational since game blending is a combinational creativity process and game design since the approach generates novel, playable games. We use Gaussian Mixture Variational Autoencoders (GMVAEs), which use a mixture of Gaussians to model the VAE latent space. Through supervised training, each component learns to encode levels from one game and lets us define new, blended games as linear combinations of these learned components. This enables generating new games that blend the input games as well as control the relative proportions of each game in the blend. We also extend prior work using conditional VAEs to perform blending and compare against the GMVAE. Our results show that both models can generate playable blended games that blend the input games in the desired proportions.

Existing methods for isolating hard subpopulations and spurious correlations in datasets often require human intervention. This can make these methods labor-intensive and dataset-specific. To address these shortcomings, we present a scalable method for automatically distilling a model's failure modes. Specifically, we harness linear classifiers to identify consistent error patterns, and, in turn, induce a natural representation of these failure modes as directions within the feature space. We demonstrate that this framework allows us to discover and automatically caption challenging subpopulations within the training dataset, and intervene to improve the model's performance on these subpopulations. Code available at https://github.com/MadryLab/failure-directions

The time series captured by a single scalp electrode (plus the reference electrode) of refractory epileptic patients is used to forecast seizures susceptibility. The time series is preprocessed, segmented, and each segment transformed into an image, using three different known methods: Recurrence Plot, Gramian Angular Field, Markov Transition Field. The likelihood of the occurrence of a seizure in a future predefined time window is computed by averaging the output of the softmax layer of a CNN, differently from the usual consideration of the output of the classification layer. By thresholding this likelihood, seizure forecasting has better performance. Interestingly, for almost every patient, the best threshold was different from 50%. The results show that this technique can predict with good results for some seizures and patients. However, more tests, namely more patients and more seizures, are needed to better understand the real potential of this technique.

Linear systems occur throughout engineering and the sciences, most notably as differential equations. In many cases the forcing function for the system is unknown, and interest lies in using noisy observations of the system to infer the forcing, as well as other unknown parameters. In differential equations, the forcing function is an unknown function of the independent variables (typically time and space), and can be modelled as a Gaussian process (GP). In this paper we show how the adjoint of a linear system can be used to efficiently infer forcing functions modelled as GPs, using a truncated basis expansion of the GP kernel. We show how exact conjugate Bayesian inference for the truncated GP can be achieved, in many cases with substantially lower computation than would be required using MCMC methods. We demonstrate the approach on systems of both ordinary and partial differential equations, and show that the basis expansion approach approximates well the true forcing with a modest number of basis vectors. Finally, we show how to infer point estimates for the non-linear model parameters, such as the kernel length-scales, using Bayesian optimisation.

The availability of clean and diverse labeled data is a major roadblock for training models on complex tasks such as visual question answering (VQA). The extensive work on large vision-and-language models has shown that self-supervised learning is effective for pretraining multimodal interactions. In this technical report, we focus on visual representations. We review and evaluate self-supervised methods to leverage unlabeled images and pretrain a model, which we then fine-tune on a custom VQA task that allows controlled evaluation and diagnosis. We compare energy-based models (EBMs) with contrastive learning (CL). While EBMs are growing in popularity, they lack an evaluation on downstream tasks. We find that both EBMs and CL can learn representations from unlabeled images that enable training a VQA model on very little annotated data. In a simple setting similar to CLEVR, we find that CL representations also improve systematic generalization, and even match the performance of representations from a larger, supervised, ImageNet-pretrained model. However, we find EBMs to be difficult to train because of instabilities and high variability in their results. Although EBMs prove useful for OOD detection, other results on supervised energy-based training and uncertainty calibration are largely negative. Overall, CL currently seems a preferable option over EBMs.

We investigate an auto-regressive formulation for the problem of smoothing time-series by manipulating the inherent objective function of the traditional moving mean smoothers. Not only the auto-regressive smoothers enforce a higher degree of smoothing, they are just as efficient as the traditional moving means and can be optimized accordingly with respect to the input dataset. Interestingly, the auto-regressive models result in moving means with exponentially tapered windows.

Clinical trials are essential for drug development but are extremely expensive and time-consuming to conduct. It is beneficial to study similar historical trials when designing a clinical trial. However, lengthy trial documents and lack of labeled data make trial similarity search difficult. We propose a zero-shot clinical trial retrieval method, Trial2Vec, which learns through self-supervision without annotating similar clinical trials. Specifically, the meta-structure of trial documents (e.g., title, eligibility criteria, target disease) along with clinical knowledge (e.g., UMLS knowledge base https://www.nlm.nih.gov/research/umls/index.html) are leveraged to automatically generate contrastive samples. Besides, Trial2Vec encodes trial documents considering meta-structure thus producing compact embeddings aggregating multi-aspect information from the whole document. We show that our method yields medically interpretable embeddings by visualization and it gets a 15% average improvement over the best baselines on precision/recall for trial retrieval, which is evaluated on our labeled 1600 trial pairs. In addition, we prove the pre-trained embeddings benefit the downstream trial outcome prediction task over 240k trials.

By inferring latent groups in the training data, recent works introduce invariant learning to the case where environment annotations are unavailable. Typically, learning group invariance under a majority/minority split is empirically shown to be effective in improving out-of-distribution generalization on many datasets. However, theoretical guarantee for these methods on learning invariant mechanisms is lacking. In this paper, we reveal the insufficiency of existing group invariant learning methods in preventing classifiers from depending on spurious correlations in the training set. Specifically, we propose two criteria on judging such sufficiency. Theoretically and empirically, we show that existing methods can violate both criteria and thus fail in generalizing to spurious correlation shifts. Motivated by this, we design a new group invariant learning method, which constructs groups with statistical independence tests, and reweights samples by group label proportion to meet the criteria. Experiments on both synthetic and real data demonstrate that the new method significantly outperforms existing group invariant learning methods in generalizing to spurious correlation shifts.

Vaccine hesitancy is considered as one main cause of the stagnant uptake ratio of COVID-19 vaccines in Europe and the US where vaccines are sufficiently supplied. Fast and accurate grasp of public attitudes toward vaccination is critical to address vaccine hesitancy, and social media platforms have proved to be an effective source of public opinions. In this paper, we describe the collection and release of a dataset of tweets related to COVID-19 vaccines. This dataset consists of the IDs of 2,198,090 tweets collected from Western Europe, 17,934 of which are annotated with the originators' vaccination stances. Our annotation will facilitate using and developing data-driven models to extract vaccination attitudes from social media posts and thus further confirm the power of social media in public health surveillance. To lay the groundwork for future research, we not only perform statistical analysis and visualisation of our dataset, but also evaluate and compare the performance of established text-based benchmarks in vaccination stance extraction. We demonstrate one potential use of our data in practice in tracking the temporal changes of public COVID-19 vaccination attitudes.

In this study, we utilize Gaussian processes, probabilistic neural network, natural gradient boosting, and quantile regression augmented gradient boosting to model lead times of laser manufacturing processes. We introduce probabilistic modelling in the domain and compare the models in terms of different abilities. While providing a comparison between the models in real-life data, our work has many use cases and substantial business value. Our results indicate that all of the models beat the company estimation benchmark that uses domain experience and have good calibration with the empirical frequencies.

Performance in natural language processing, and specifically for the question-answer task, is typically measured by comparing a model\'s most confident (primary) prediction to golden answers (the ground truth). We are making the case that it is also useful to quantify how close a model came to predicting a correct answer even for examples that failed. We define the Golden Rank (GR) of an example as the rank of its most confident prediction that exactly matches a ground truth, and show why such a match always exists. For the 16 transformer models we analyzed, the majority of exactly matched golden answers in secondary prediction space hover very close to the top rank. We refer to secondary predictions as those ranking above 0 in descending confidence probability order. We demonstrate how the GR can be used to classify questions and visualize their spectrum of difficulty, from persistent near successes to persistent extreme failures. We derive a new aggregate statistic over entire test sets, named the Golden Rank Interpolated Median (GRIM) that quantifies the proximity of failed predictions to the top choice made by the model. To develop some intuition and explore the applicability of these metrics we use the Stanford Question Answering Dataset (SQuAD-2) and a few popular transformer models from the Hugging Face hub. We first demonstrate that the GRIM is not directly correlated with the F1 and exact match (EM) scores. We then calculate and visualize these scores for various transformer architectures, probe their applicability in error analysis by clustering failed predictions, and compare how they relate to other training diagnostics such as the EM and F1 scores. We finally suggest various research goals, such as broadening data collection for these metrics and their possible use in adversarial training.

An automatic encoder (AE) extreme learning machine (ELM)-AE-ELM model is proposed to predict the NOx emission concentration based on the combination of mutual information algorithm (MI), AE, and ELM. First, the importance of practical variables is computed by the MI algorithm, and the mechanism is analyzed to determine the variables related to the NOx emission concentration. Then, the time delay correlations between the selected variables and NOx emission concentration are further analyzed to reconstruct the modeling data. Subsequently, the AE is applied to extract hidden features within the input variables. Finally, an ELM algorithm establishes the relationship between the NOx emission concentration and deep features. The experimental results on practical data indicate that the proposed model shows promising performance compared to state-of-art models.

In deterministic optimization, it is typically assumed that all parameters of the problem are fixed and known. In practice, however, some parameters may be a priori unknown but can be estimated from historical data. A typical predict-then-optimize approach separates predictions and optimization into two stages. Recently, end-to-end predict-then-optimize has become an attractive alternative. In this work, we present the PyEPO package, a PyTorch-based end-to-end predict-then-optimize library in Python. To the best of our knowledge, PyEPO (pronounced like "pineapple" with a silent "n") is the first such generic tool for linear and integer programming with predicted objective function coefficients. It provides two base algorithms: the first is based on the convex surrogate loss function from the seminal work of Elmachtoub & Grigas (2021), and the second is based on the differentiable black-box solver approach of Vlastelica et al. (2019). PyEPO provides a simple interface for the definition of new optimization problems, the implementation of state-of-the-art predict-then-optimize training algorithms, the use of custom neural network architectures, and the comparison of end-to-end approaches with the two-stage approach. PyEPO enables us to conduct a comprehensive set of experiments comparing a number of end-to-end and two-stage approaches along axes such as prediction accuracy, decision quality, and running time on problems such as Shortest Path, Multiple Knapsack, and the Traveling Salesperson Problem. We discuss some empirical insights from these experiments which could guide future research. PyEPO and its documentation are available at https://github.com/khalil-research/PyEPO.

Bayesian Improved Surname Geocoding (BISG) is the most popular method for proxying race/ethnicity in voter registration files that do not contain it. This paper benchmarks BISG against a range of previously untested machine learning alternatives, using voter files with self-reported race/ethnicity from California, Florida, North Carolina, and Georgia. This analysis yields three key findings. First, when given the exact same inputs, BISG and machine learning perform similarly for estimating aggregate racial/ethnic composition. Second, machine learning outperforms BISG at individual classification of race/ethnicity. Third, the performance of all methods varies substantially across states. These results suggest that pre-trained machine learning models are preferable to BISG for individual classification. Furthermore, mixed results at the precinct level and across states underscore the need for researchers to empirically validate their chosen race/ethnicity proxy in their populations of interest.

End-to-end spoken language understanding (SLU) systems benefit from pretraining on large corpora, followed by fine-tuning on application-specific data. The resulting models are too large for on-edge applications. For instance, BERT-based systems contain over 110M parameters. Observing the model is overparameterized, we propose lean transformer structure where the dimension of the attention mechanism is automatically reduced using group sparsity. We propose a variant where the learned attention subspace is transferred to an attention bottleneck layer. In a low-resource setting and without pre-training, the resulting compact SLU model achieves accuracies competitive with pre-trained large models.

This research aims to build generative language models in the patent domain and to evaluate the models from a human-centric perspective. The evaluation metric is to calculate the ratio of keystrokes that can be saved for a user in an autocomplete context based on the prediction of the generative models. The performance of models in different sizes can also be evaluated in such a metric by measuring a number of newly granted patents. On the basis of the metric, it is found that the largest model is not necessarily the best. Several models are pre-trained from scratch with patent corpus and are released. The experiments in this manuscript focus on patent claims, but the ideas and implementation can be applied to other parts of a patent document. Furthermore, this research is motivated to measure how close the pre-trained language model can generate a newly granted patent claim. Or, conversely, the task is to measure the probabilities for the model to generate each token text given the newly granted patent claim. In addition, this manuscript raises several legal implications on patent law for potential interdisciplinary research in the future. In particular, can the metric based on model prediction be a metric to measure the nonobviousness requirement in the patent law?

Modeling the energy and forces of atomic systems is a fundamental problem in computational chemistry with the potential to help address many of the world's most pressing problems, including those related to energy scarcity and climate change. These calculations are traditionally performed using Density Functional Theory, which is computationally very expensive. Machine learning has the potential to dramatically improve the efficiency of these calculations from days or hours to seconds. We propose the Spherical Channel Network (SCN) to model atomic energies and forces. The SCN is a graph neural network where nodes represent atoms and edges their neighboring atoms. The atom embeddings are a set of spherical functions, called spherical channels, represented using spherical harmonics. We demonstrate, that by rotating the embeddings based on the 3D edge orientation, more information may be utilized while maintaining the rotational equivariance of the messages. While equivariance is a desirable property, we find that by relaxing this constraint in both message passing and aggregation, improved accuracy may be achieved. We demonstrate state-of-the-art results on the large-scale Open Catalyst 2020 dataset in both energy and force prediction for numerous tasks and metrics.

Tree Ensemble (TE) models (e.g. Gradient Boosted Trees and Random Forests) often provide higher prediction performance compared to single decision trees. However, TE models generally lack transparency and interpretability, as humans have difficulty understanding their decision logic. This paper presents a novel approach to convert a TE trained for a binary classification task, to a rule list (RL) that is a global equivalent to the TE and is comprehensible for a human. This RL captures all necessary and sufficient conditions for decision making by the TE. Experiments on benchmark datasets demonstrate that, compared to state-of-the-art methods, (i) predictions from the RL generated by TE2Rules have high fidelity with respect to the original TE, (ii) the RL from TE2Rules has high interpretability measured by the number and the length of the decision rules, (iii) the run-time of TE2Rules algorithm can be reduced significantly at the cost of a slightly lower fidelity, and (iv) the RL is a fast alternative to the state-of-the-art rule-based instance-level outcome explanation techniques.

The growing number of IoT devices and their use to monitor the operation of machines and equipment increases interest in anomaly detection algorithms running on devices. However, the difficulty is the limitations of the available computational and memory resources on the devices. In the case of microcontrollers (MCUs), these are single megabytes of program and several hundred kilobytes of working memory. Consequently, algorithms must be appropriately matched to the capabilities of the devices. In the paper, we analyse the processing pipeline for anomaly detection and implementation of the Local Outliner Factor (LOF) algorithm on a MCU. We also show that it is possible to train such an algorithm directly on the device, which gives great potential to use the solution in real devices.

Rights provisioned within data protection regulations, permit patients to request that knowledge about their information be eliminated by data holders. With the advent of AI learned on data, one can imagine that such rights can extent to requests for forgetting knowledge of patient's data within AI models. However, forgetting patients' imaging data from AI models, is still an under-explored problem. In this paper, we study the influence of patient data on model performance and formulate two hypotheses for a patient's data: either they are common and similar to other patients or form edge cases, i.e. unique and rare cases. We show that it is not possible to easily forget patient data. We propose a targeted forgetting approach to perform patient-wise forgetting. Extensive experiments on the benchmark Automated Cardiac Diagnosis Challenge dataset showcase the improved performance of the proposed targeted forgetting approach as opposed to a state-of-the-art method.

Many performance gains achieved by massive multiple-input and multiple-output depend on the accuracy of the downlink channel state information (CSI) at the transmitter (base station), which is usually obtained by estimating at the receiver (user terminal) and feeding back to the transmitter. The overhead of CSI feedback occupies substantial uplink bandwidth resources, especially when the number of the transmit antennas is large. Deep learning (DL)-based CSI feedback refers to CSI compression and reconstruction by a DL-based autoencoder and can greatly reduce feedback overhead. In this paper, a comprehensive overview of state-of-the-art research on this topic is provided, beginning with basic DL concepts widely used in CSI feedback and then categorizing and describing some existing DL-based feedback works. The focus is on novel neural network architectures and utilization of communication expert knowledge to improve CSI feedback accuracy. Works on bit-level CSI feedback and joint design of CSI feedback with other communication modules are also introduced, and some practical issues, including training dataset collection, online training, complexity, generalization, and standardization effect, are discussed. At the end of the paper, some challenges and potential research directions associated with DL-based CSI feedback in future wireless communication systems are identified.

Motivation: Medical image analysis involves tasks to assist physicians in qualitative and quantitative analysis of lesions or anatomical structures, significantly improving the accuracy and reliability of diagnosis and prognosis. Traditionally, these tasks are finished by physicians or medical physicists and lead to two major problems: (i) low efficiency; (ii) biased by personal experience. In the past decade, many machine learning methods have been applied to accelerate and automate the image analysis process. Compared to the enormous deployments of supervised and unsupervised learning models, attempts to use reinforcement learning in medical image analysis are scarce. This review article could serve as the stepping-stone for related research. Significance: From our observation, though reinforcement learning has gradually gained momentum in recent years, many researchers in the medical analysis field find it hard to understand and deploy in clinics. One cause is lacking well-organized review articles targeting readers lacking professional computer science backgrounds. Rather than providing a comprehensive list of all reinforcement learning models in medical image analysis, this paper may help the readers to learn how to formulate and solve their medical image analysis research as reinforcement learning problems. Approach & Results: We selected published articles from Google Scholar and PubMed. Considering the scarcity of related articles, we also included some outstanding newest preprints. The papers are carefully reviewed and categorized according to the type of image analysis task. We first review the basic concepts and popular models of reinforcement learning. Then we explore the applications of reinforcement learning models in landmark detection. Finally, we conclude the article by discussing the reviewed reinforcement learning approaches' limitations and possible improvements.

Most works on modeling the conversation history in Conversational Question Answering (CQA) report a single main result on a common CQA benchmark. While existing models show impressive results on CQA leaderboards, it remains unclear whether they are robust to shifts in setting (sometimes to more realistic ones), training data size (e.g. from large to small sets) and domain. In this work, we design and conduct the first large-scale robustness study of history modeling approaches for CQA. We find that high benchmark scores do not necessarily translate to strong robustness, and that various methods can perform extremely differently under different settings. Equipped with the insights from our study, we design a novel prompt-based history modeling approach, and demonstrate its strong robustness across various settings. Our approach is inspired by existing methods that highlight historic answers in the passage. However, instead of highlighting by modifying the passage token embeddings, we add textual prompts directly in the passage text. Our approach is simple, easy-to-plug into practically any model, and highly effective, thus we recommend it as a starting point for future model developers. We also hope that our study and insights will raise awareness to the importance of robustness-focused evaluation, in addition to obtaining high leaderboard scores, leading to better CQA systems.

This paper presents a Double Deep Q-Network algorithm for trading single assets, namely the E-mini S&P 500 continuous futures contract. We use a proven setup as the foundation for our environment with multiple extensions. The features of our trading agent are constantly being expanded to include additional assets such as commodities, resulting in four models. We also respond to environmental conditions, including costs and crises. Our trading agent is first trained for a specific time period and tested on new data and compared with the long-and-hold strategy as a benchmark (market). We analyze the differences between the various models and the in-sample/out-of-sample performance with respect to the environment. The experimental results show that the trading agent follows an appropriate behavior. It can adjust its policy to different circumstances, such as more extensive use of the neutral position when trading costs are present. Furthermore, the net asset value exceeded that of the benchmark, and the agent outperformed the market in the test set. We provide initial insights into the behavior of an agent in a financial domain using a DDQN algorithm. The results of this study can be used for further development.

Benefiting from the digitization of healthcare data and the development of computing power, machine learning methods are increasingly used in the healthcare domain. Fairness problems have been identified in machine learning for healthcare, resulting in an unfair allocation of limited healthcare resources or excessive health risks for certain groups. Therefore, addressing the fairness problems has recently attracted increasing attention from the healthcare community. However, the intersection of machine learning for healthcare and fairness in machine learning remains understudied. In this review, we build the bridge by exposing fairness problems, summarizing possible biases, sorting out mitigation methods and pointing out challenges along with opportunities for the future.

As critically ill patients frequently develop anemia or coagulopathy, transfusion of blood products is a frequent intervention in the Intensive Care Units (ICU). However, inappropriate transfusion decisions made by physicians are often associated with increased risk of complications and higher hospital costs. In this work, we aim to develop a decision support tool that uses available patient information for transfusion decision-making on three common blood products (red blood cells, platelets, and fresh frozen plasma). To this end, we adopt an off-policy batch reinforcement learning (RL) algorithm, namely, discretized Batch Constrained Q-learning, to determine the best action (transfusion or not) given observed patient trajectories. Simultaneously, we consider different state representation approaches and reward design mechanisms to evaluate their impacts on policy learning. Experiments are conducted on two real-world critical care datasets: the MIMIC-III and the UCSF. Results demonstrate that policy recommendations on transfusion achieved comparable matching against true hospital policies via accuracy and weighted importance sampling evaluations on the MIMIC-III dataset. Furthermore, a combination of transfer learning (TL) and RL on the data-scarce UCSF dataset can provide up to $17.02% improvement in terms of accuracy, and up to 18.94% and 21.63% improvement in jump-start and asymptotic performance in terms of weighted importance sampling averaged over three transfusion tasks. Finally, simulations on transfusion decisions suggest that the transferred RL policy could reduce patients' estimated 28-day mortality rate by 2.74% and decreased acuity rate by 1.18% on the UCSF dataset.

Widely observed neural scaling laws, in which error falls off as a power of the training set size, model size, or both, have driven substantial performance improvements in deep learning. However, these improvements through scaling alone require considerable costs in compute and energy. Here we focus on the scaling of error with dataset size and show how both in theory and practice we can break beyond power law scaling and reduce it to exponential scaling instead if we have access to a high-quality data pruning metric that ranks the order in which training examples should be discarded to achieve any pruned dataset size. We then test this new exponential scaling prediction with pruned dataset size empirically, and indeed observe better than power law scaling performance on ResNets trained on CIFAR-10, SVHN, and ImageNet. Given the importance of finding high-quality pruning metrics, we perform the first large-scale benchmarking study of ten different data pruning metrics on ImageNet. We find most existing high performing metrics scale poorly to ImageNet, while the best are computationally intensive and require labels for every image. We therefore developed a new simple, cheap and scalable self-supervised pruning metric that demonstrates comparable performance to the best supervised metrics. Overall, our work suggests that the discovery of good data-pruning metrics may provide a viable path forward to substantially improved neural scaling laws, thereby reducing the resource costs of modern deep learning.

Electrocardiogram (ECG) is a simple non-invasive measure to identify heart-related issues such as irregular heartbeats known as arrhythmias. While artificial intelligence and machine learning is being utilized in a wide range of healthcare related applications and datasets, many arrhythmia classifiers using deep learning methods have been proposed in recent years. However, sizes of the available datasets from which to build and assess machine learning models is often very small and the lack of well-annotated public ECG datasets is evident. In this paper, we propose a deep transfer learning framework that is aimed to perform classification on a small size training dataset. The proposed method is to fine-tune a general-purpose image classifier ResNet-18 with MIT-BIH arrhythmia dataset in accordance with the AAMI EC57 standard. This paper further investigates many existing deep learning models that have failed to avoid data leakage against AAMI recommendations. We compare how different data split methods impact the model performance. This comparison study implies that future work in arrhythmia classification should follow the AAMI EC57 standard when using any including MIT-BIH arrhythmia dataset.

Language Models such as BERT have grown in popularity due to their ability to be pre-trained and perform robustly on a wide range of Natural Language Processing tasks. Often seen as an evolution over traditional word embedding techniques, they can produce semantic representations of text, useful for tasks such as semantic similarity. However, state-of-the-art models often have high computational requirements and lack global context or domain knowledge which is required for complete language understanding. To address these limitations, we investigate the benefits of knowledge incorporation into the fine-tuning stages of BERT. An existing K-BERT model, which enriches sentences with triplets from a Knowledge Graph, is adapted for the English language and extended to inject contextually relevant information into sentences. As a side-effect, changes made to K-BERT for accommodating the English language also extend to other word-based languages. Experiments conducted indicate that injected knowledge introduces noise. We see statistically significant improvements for knowledge-driven tasks when this noise is minimised. We show evidence that, given the appropriate task, modest injection with relevant, high-quality knowledge is most performant.

Traffic congestion anomaly detection is of paramount importance in intelligent traffic systems. The goals of transportation agencies are two-fold: to monitor the general traffic conditions in the area of interest and to locate road segments under abnormal congestion states. Modeling congestion patterns can achieve these goals for citywide roadways, which amounts to learning the distribution of multivariate time series (MTS). However, existing works are either not scalable or unable to capture the spatial-temporal information in MTS simultaneously. To this end, we propose a principled and comprehensive framework consisting of a data-driven generative approach that can perform tractable density estimation for detecting traffic anomalies. Our approach first clusters segments in the feature space and then uses conditional normalizing flow to identify anomalous temporal snapshots at the cluster level in an unsupervised setting. Then, we identify anomalies at the segment level by using a kernel density estimator on the anomalous cluster. Extensive experiments on synthetic datasets show that our approach significantly outperforms several state-of-the-art congestion anomaly detection and diagnosis methods in terms of Recall and F1-Score. We also use the generative model to sample labeled data, which can train classifiers in a supervised setting, alleviating the lack of labeled data for anomaly detection in sparse settings.

Deep recommender systems jointly leverage the retrieval and ranking operations to generate the recommendation result. The retriever targets selecting a small set of relevant candidates from the entire items with high efficiency; while the ranker, usually more precise but time-consuming, is supposed to identify the best items out of the retrieved candidates with high precision. However, the retriever and ranker are usually trained in poorly-cooperative ways, leading to limited recommendation performances when working as an entirety. In this work, we propose a novel DRS training framework CoRR(short for Cooperative Retriever and Ranker), where the retriever and ranker can be mutually reinforced. On one hand, the retriever is learned from recommendation data and the ranker via knowledge distillation; knowing that the ranker is more precise, the knowledge distillation may provide extra weak-supervision signals for the improvement of retrieval quality. On the other hand, the ranker is trained by learning to discriminate the truth positive items from hard negative candidates sampled from the retriever. With the iteration going on, the ranker may become more precise, which in return gives rise to informative training signals for the retriever; meanwhile, with the improvement of retriever, harder negative candidates can be sampled, which contributes to a higher discriminative capability of the ranker. To facilitate the effective conduct of CoRR, an asymptotic-unbiased approximation of KL divergence is introduced for the knowledge distillation over sampled items; besides, a scalable and adaptive strategy is developed to efficiently sample from the retriever. Comprehensive experimental studies are performed over four large-scale benchmark datasets, where CoRR improves the overall recommendation quality resulting from the cooperation between retriever and ranker.

Semi-supervised learning is the problem of training an accurate predictive model by combining a small labeled dataset with a presumably much larger unlabeled dataset. Many methods for semi-supervised deep learning have been developed, including pseudolabeling, consistency regularization, and contrastive learning techniques. Pseudolabeling methods however are highly susceptible to confounding, in which erroneous pseudolabels are assumed to be true labels in early iterations, thereby causing the model to reinforce its prior biases and thereby fail to generalize to strong predictive performance. We present a new approach to suppress confounding errors through a method we describe as Semi-supervised Contrastive Outlier removal for Pseudo Expectation Maximization (SCOPE). Like basic pseudolabeling, SCOPE is related to Expectation Maximization (EM), a latent variable framework which can be extended toward understanding cluster-assumption deep semi-supervised algorithms. However, unlike basic pseudolabeling which fails to adequately take into account the probability of the unlabeled samples given the model, SCOPE introduces an outlier suppression term designed to improve the behavior of EM iteration given a discrimination DNN backbone in the presence of outliers. Our results show that SCOPE greatly improves semi-supervised classification accuracy over a baseline, and furthermore when combined with consistency regularization achieves the highest reported accuracy for the semi-supervised CIFAR-10 classification task using 250 and 4000 labeled samples. Moreover, we show that SCOPE reduces the prevalence of confounding errors during pseudolabeling iterations by pruning erroneous high-confidence pseudolabeled samples that would otherwise contaminate the labeled set in subsequent retraining iterations.

The attention mechanisms of transformers effectively extract pertinent information from the input sequence. However, the quadratic complexity of self-attention w.r.t the sequence length incurs heavy computational and memory burdens, especially for tasks with long sequences. Existing accelerators face performance degradation in these tasks. To this end, we propose SALO to enable hybrid sparse attention mechanisms for long sequences. SALO contains a data scheduler to map hybrid sparse attention patterns onto hardware and a spatial accelerator to perform the efficient attention computation. We show that SALO achieves 17.66x and 89.33x speedup on average compared to GPU and CPU implementations, respectively, on typical workloads, i.e., Longformer and ViL.

Computer-aided methods have shown added value for diagnosing and predicting brain disorders and can thus support decision making in clinical care and treatment planning. This chapter will provide insight into the type of methods, their working, their input data - such as cognitive tests, imaging and genetic data - and the types of output they provide. We will focus on specific use cases for diagnosis, i.e. estimating the current 'condition' of the patient, such as early detection and diagnosis of dementia, differential diagnosis of brain tumours, and decision making in stroke. Regarding prediction, i.e. estimation of the future 'condition' of the patient, we will zoom in on use cases such as predicting the disease course in multiple sclerosis and predicting patient outcomes after treatment in brain cancer. Furthermore, based on these use cases, we will assess the current state-of-the-art methodology and highlight current efforts on benchmarking of these methods and the importance of open science therein. Finally, we assess the current clinical impact of computer-aided methods and discuss the required next steps to increase clinical impact.  ( 2 min )

The authors recently gave an $n^{O(\log\log n)}$ time membership query algorithm for properly learning decision trees under the uniform distribution (Blanc et al., 2021). The previous fastest algorithm for this problem ran in $n^{O(\log n)}$ time, a consequence of Ehrenfeucht and Haussler (1989)'s classic algorithm for the distribution-free setting. In this article we highlight the natural open problem of obtaining a polynomial-time algorithm, discuss possible avenues towards obtaining it, and state intermediate milestones that we believe are of independent interest.

This work investigates the compatibility between label smoothing (LS) and knowledge distillation (KD). Contemporary findings addressing this thesis statement take dichotomous standpoints: Muller et al. (2019) and Shen et al. (2021b). Critically, there is no effort to understand and resolve these contradictory findings, leaving the primal question -- to smooth or not to smooth a teacher network? -- unanswered. The main contributions of our work are the discovery, analysis and validation of systematic diffusion as the missing concept which is instrumental in understanding and resolving these contradictory findings. This systematic diffusion essentially curtails the benefits of distilling from an LS-trained teacher, thereby rendering KD at increased temperatures ineffective. Our discovery is comprehensively supported by large-scale experiments, analyses and case studies including image classification, neural machine translation and compact student distillation tasks spanning across multiple datasets and teacher-student architectures. Based on our analysis, we suggest practitioners to use an LS-trained teacher with a low-temperature transfer to achieve high performance students. Code and models are available at https://keshik6.github.io/revisiting-ls-kd-compatibility/

Many generative models synthesize data by transforming a standard Gaussian random variable using a deterministic neural network. Among these models are the Variational Autoencoders and the Generative Adversarial Networks. In this work, we call them "push-forward" models and study their expressivity. We show that the Lipschitz constant of these generative networks has to be large in order to fit multimodal distributions. More precisely, we show that the total variation distance and the Kullback-Leibler divergence between the generated and the data distribution are bounded from below by a constant depending on the mode separation and the Lipschitz constant. Since constraining the Lipschitz constants of neural networks is a common way to stabilize generative models, there is a provable trade-off between the ability of push-forward models to approximate multimodal distributions and the stability of their training. We validate our findings on one-dimensional and image datasets and empirically show that generative models consisting of stacked networks with stochastic input at each step, such as diffusion models do not suffer of such limitations.

Kernel ridge regression (KRR) has recently attracted renewed interest due to its potential for explaining the transient effects, such as double descent, that emerge during neural network training. In this work, we study how the alignment between the target function and the kernel affects the performance of the KRR. We focus on the truncated KRR (TKRR) which utilizes an additional parameter that controls the spectral truncation of the kernel matrix. We show that for polynomial alignment, there is an \emph{over-aligned} regime, in which TKRR can achieve a faster rate than what is achievable by full KRR. The rate of TKRR can improve all the way to the parametric rate, while that of full KRR is capped at a sub-optimal value. This shows that target alignemnt can be better leveraged by utilizing spectral truncation in kernel methods. We also consider the bandlimited alignment setting and show that the regularization surface of TKRR can exhibit transient effects including multiple descent and non-monotonic behavior. Our results show that there is a strong and quantifable relation between the shape of the \emph{alignment spectrum} and the generalization performance of kernel methods, both in terms of rates and in finite samples.

Training an ensemble of different sub-models has empirically proven to be an effective strategy to improve deep neural networks' adversarial robustness. Current ensemble training methods for image recognition usually encode the image labels by one-hot vectors, which neglect dependency relationships between the labels. Here we propose a novel adversarial training approach that learns the conditional dependencies between labels and the model ensemble jointly. We test our approach on widely used datasets MNIST, FasionMNIST and CIFAR-10. Results show that our approach is more robust against black-box attacks compared with state-of-the-art methods. Our code is available at https://github.com/ZJLAB-AMMI/LSD.

In recent years, there have been significant advances in the use of deep learning methods in inverse problems such as denoising, compressive sensing, inpainting, and super-resolution. While this line of works has predominantly been driven by practical algorithms and experiments, it has also given rise to a variety of intriguing theoretical problems. In this paper, we survey some of the prominent theoretical developments in this line of works, focusing in particular on generative priors, untrained neural network priors, and unfolding algorithms. In addition to summarizing existing results in these topics, we highlight several ongoing challenges and open problems.

For the classification of traffic scenes, a description model is necessary that can describe the scene in a uniform way, independent of its domain. A model to describe a traffic scene in a semantic way is described in this paper. The description model allows to describe a traffic scene independently of the road geometry and road topology. Here, the traffic participants are projected onto the road network and represented as nodes in a graph. Depending on the relative location between two traffic participants with respect to the road topology, semantically classified edges are created between the corresponding nodes. For concretization, the edge attributes are extended by relative distances and velocities between both traffic participants with regard to the course of the lane. An important aspect of the description is that it can be converted easily into a machine-readable format. The current description focuses on dynamic objects of a traffic scene and considers traffic participants, such as pedestrians or vehicles.

In this paper, we propose Multiresolution Equivariant Graph Variational Autoencoders (MGVAE), the first hierarchical generative model to learn and generate graphs in a multiresolution and equivariant manner. At each resolution level, MGVAE employs higher order message passing to encode the graph while learning to partition it into mutually exclusive clusters and coarsening into a lower resolution that eventually creates a hierarchy of latent distributions. MGVAE then constructs a hierarchical generative model to variationally decode into a hierarchy of coarsened graphs. Importantly, our proposed framework is end-to-end permutation equivariant with respect to node ordering. MGVAE achieves competitive results with several generative tasks including general graph generation, molecular generation, unsupervised molecular representation learning to predict molecular properties, link prediction on citation graphs, and graph-based image generation.

Thermal comfort in indoor environments has an enormous impact on the health, well-being, and performance of occupants. Given the focus on energy efficiency and Internet-of-Things enabled smart buildings, machine learning (ML) is being increasingly used for data-driven thermal comfort (TC) prediction. Generally, ML-based solutions are proposed for air-conditioned or HVAC ventilated buildings and the models are primarily designed for adults. On the other hand, naturally ventilated (NV) buildings are the norm in most countries. They are also ideal for energy conservation and long-term sustainability goals. However, the indoor environment of NV buildings lacks thermal regulation and varies significantly across spatial contexts. These factors make TC prediction extremely challenging. Thus, determining the impact of the building environment on the performance of TC models is important. Further, the generalization capability of TC prediction models across different NV indoor spaces needs to be studied. This work addresses these problems. Data is gathered through month-long field experiments conducted in 5 naturally ventilated school buildings, involving 512 primary school students. The impact of spatial variability on student comfort is demonstrated through variation in prediction accuracy (by as much as 71%). The influence of building environment on TC prediction is also demonstrated through variation in feature importance. Further, a comparative analysis of spatial variability in model performance is done for children (our dataset) and adults (ASHRAE-II database). Finally, the generalization capability of thermal comfort models in NV classrooms is assessed and major challenges are highlighted.

A central challenge in every field of biology is to use existing measurements to predict the outcomes of future experiments. In this work, we consider the wealth of antibody inhibition data against variants of the influenza virus. Due to this virus's genetic diversity and evolvability, the variants examined in one study will often have little-to-no overlap with other studies, making it difficult to discern common patterns or unify datasets for further analysis. To that end, we develop a computational framework that predicts how an antibody or serum would inhibit any variant from any other study. We use this framework to greatly expand 7 influenza datasets utilizing hemagglutination inhibition, validating our method upon 200,000 existing measurements and predicting more than 2,000,000 new values along with their prediction uncertainties. This data-driven approach does not require any information beyond each virus's name and measurements, and even datasets with as few as 5 viruses can be expanded, making this approach widely applicable. Future influenza studies using hemagglutination inhibition can directly utilize our curated datasets to predict newly measured antibody responses against ~80 H3N2 influenza viruses from 1968-2011, whereas immunological studies utilizing other viruses or a different assay only need to find a single partially-overlapping dataset to extend their work. In essence, this approach enables a shift in perspective when analyzing data from "what you see is what you get" into "what anyone sees is what everyone gets."

A novel way of using neural networks to learn the dynamics of time delay systems from sequential data is proposed. A neural network with trainable delays is used to approximate the right hand side of a delay differential equation. We relate the delay differential equation to an ordinary differential equation by discretizing the time history and train the corresponding neural ordinary differential equation (NODE) to learn the dynamics. An example on learning the dynamics of the Mackey-Glass equation using data from chaotic behavior is given. After learning both the nonlinearity and the time delay, we demonstrate that the bifurcation diagram of the neural network matches that of the original system.

We present our experience as annotators in the creation of high-quality, adversarial machine-reading-comprehension data for extractive QA for Task 1 of the First Workshop on Dynamic Adversarial Data Collection (DADC). DADC is an emergent data collection paradigm with both models and humans in the loop. We set up a quasi-experimental annotation design and perform quantitative analyses across groups with different numbers of annotators focusing on successful adversarial attacks, cost analysis, and annotator confidence correlation. We further perform a qualitative analysis of our perceived difficulty of the task given the different topics of the passages in our dataset and conclude with recommendations and suggestions that might be of value to people working on future DADC tasks and related annotation interfaces.

This paper derives a perturbation bound on the optimal subspace estimator obtained from a subset of its canonical projections contaminated by noise. This fundamental result has important implications in matrix completion, subspace clustering, and related problems.

The problem of algorithmic recourse has been explored for supervised machine learning models, to provide more interpretable, transparent and robust outcomes from decision support systems. An unexplored area is that of algorithmic recourse for anomaly detection, specifically for tabular data with only discrete feature values. Here the problem is to present a set of counterfactuals that are deemed normal by the underlying anomaly detection model so that applications can utilize this information for explanation purposes or to recommend countermeasures. We present an approach -- Context preserving Algorithmic Recourse for Anomalies in Tabular data (CARAT), that is effective, scalable, and agnostic to the underlying anomaly detection model. CARAT uses a transformer based encoder-decoder model to explain an anomaly by finding features with low likelihood. Subsequently semantically coherent counterfactuals are generated by modifying the highlighted features, using the overall context of features in the anomalous instance(s). Extensive experiments help demonstrate the efficacy of CARAT.  ( 2 min )

Recurrent Neural Networks (RNNs) have achieved tremendous success in sequential data processing. However, it is quite challenging to interpret and verify RNNs' behaviors directly. To this end, many efforts have been made to extract finite automata from RNNs. Existing approaches such as exact learning are effective in extracting finite-state models to characterize the state dynamics of RNNs for formal languages, but are limited in the scalability to process natural languages. Compositional approaches that are scablable to natural languages fall short in extraction precision. In this paper, we identify the transition sparsity problem that heavily impacts the extraction precision. To address this problem, we propose a transition rule extraction approach, which is scalable to natural language processing models and effective in improving extraction precision. Specifically, we propose an empirical method to complement the missing rules in the transition diagram. In addition, we further adjust the transition matrices to enhance the context-aware ability of the extracted weighted finite automaton (WFA). Finally, we propose two data augmentation tactics to track more dynamic behaviors of the target RNN. Experiments on two popular natural language datasets show that our method can extract WFA from RNN for natural language processing with better precision than existing approaches.  ( 2 min )

Federated learning (FL) is a machine learning technique that enables participants to collaboratively train high-quality models without exchanging their private data. Participants utilizing cross-silo FL (CS-FL) settings are independent organizations with different task needs, and they are concerned not only with data privacy but also with independently training their unique models due to intellectual property considerations. Most existing FL methods are incapable of satisfying the above scenarios. In this paper, we propose a FL method based on the pseudolabeling of unlabeled data via a process such as cotraining. To the best of our knowledge, this is the first FL method that is simultaneously compatible with heterogeneous tasks, heterogeneous models, and heterogeneous training algorithms. Experimental results show that the proposed method achieves better performance than competing ones. This is especially true for non-independent and identically distributed (IID) settings and heterogeneous models, where the proposed method achieves a 35% performance improvement.

Large pre-trained generative models are known to occasionally provide samples that may be undesirable for various reasons. The standard way to mitigate this is to re-train the models differently. In this work, we take a different, more compute-friendly approach and investigate how to post-edit a model after training so that it forgets certain kinds of samples. We provide three different algorithms for GANs that differ on how the samples to be forgotten are described. Extensive evaluations on real-world image datasets show that our algorithms are capable of forgetting data while retaining high generation quality at a fraction of the cost of full re-training.

A key challenge in science and engineering is to design experiments to learn about some unknown quantity of interest. Classical experimental design optimally allocates the experimental budget to maximize a notion of utility (e.g., reduction in uncertainty about the unknown quantity). We consider a rich setting, where the experiments are associated with states in a {\em Markov chain}, and we can only choose them by selecting a {\em policy} controlling the state transitions. This problem captures important applications, from exploration in reinforcement learning to spatial monitoring tasks. We propose an algorithm -- \textsc{markov-design} -- that efficiently selects policies whose measurement allocation \emph{provably converges to the optimal one}. The algorithm is sequential in nature, adapting its choice of policies (experiments) informed by past measurements. In addition to our theoretical analysis, we showcase our framework on applications in ecological surveillance and pharmacology.

We study the problem of learning robust acoustic models in adverse environments, characterized by a significant mismatch between training and test conditions. This problem is of paramount importance for the deployment of speech recognition systems that need to perform well in unseen environments. First, we characterize data augmentation theoretically as an instance of vicinal risk minimization, which aims at improving risk estimates during training by replacing the delta functions that define the empirical density over the input space with an approximation of the marginal population density in the vicinity of the training samples. More specifically, we assume that local neighborhoods centered at training samples can be approximated using a mixture of Gaussians, and demonstrate theoretically that this can incorporate robust inductive bias into the learning process. We then specify the individual mixture components implicitly via data augmentation schemes, designed to address common sources of spurious correlations in acoustic models. To avoid potential confounding effects on robustness due to information loss, which has been associated with standard feature extraction techniques (e.g., FBANK and MFCC features), we focus on the waveform-based setting. Our empirical results show that the approach can generalize to unseen noise conditions, with 150% relative improvement in out-of-distribution generalization compared to training using the standard risk minimization principle. Moreover, the results demonstrate competitive performance relative to models learned using a training sample designed to match the acoustic conditions characteristic of test utterances.

We propose cKAM, cyclical Kernel Adaptive Metropolis, which incorporates a cyclical stepsize scheme to allow control for exploration and sampling. We show that on a crafted bimodal distribution, existing Adaptive Metropolis type algorithms would fail to converge to the true posterior distribution. We point out that this is because adaptive samplers estimates the local/global covariance structure using past history of the chain, which will lead to adaptive algorithms be trapped in a local mode. We demonstrate that cKAM encourages exploration of the posterior distribution and allows the sampler to escape from a local mode, while maintaining the high performance of adaptive methods.

Diadochokinetic speech tasks (DDK), in which participants repeatedly produce syllables, are commonly used as part of the assessment of speech motor impairments. These studies rely on manual analyses that are time-intensive, subjective, and provide only a coarse-grained picture of speech. This paper presents two deep neural network models that automatically segment consonants and vowels from unannotated, untranscribed speech. Both models work on the raw waveform and use convolutional layers for feature extraction. The first model is based on an LSTM classifier followed by fully connected layers, while the second model adds more convolutional layers followed by fully connected layers. These segmentations predicted by the models are used to obtain measures of speech rate and sound duration. Results on a young healthy individuals dataset show that our LSTM model outperforms the current state-of-the-art systems and performs comparably to trained human annotators. Moreover, the LSTM model also presents comparable results to trained human annotators when evaluated on unseen older individuals with Parkinson's Disease dataset.

Users have the right to have their data deleted by third-party learned systems, as codified by recent legislation such as the General Data Protection Regulation (GDPR) and the California Consumer Privacy Act (CCPA). Such data deletion can be accomplished by full re-training, but this incurs a high computational cost for modern machine learning models. To avoid this cost, many approximate data deletion methods have been developed for supervised learning. Unsupervised learning, in contrast, remains largely an open problem when it comes to (approximate or exact) efficient data deletion. In this paper, we propose a density-ratio-based framework for generative models. Using this framework, we introduce a fast method for approximate data deletion and a statistical test for estimating whether or not training points have been deleted. We provide theoretical guarantees under various learner assumptions and empirically demonstrate our methods across a variety of generative methods.

We study a fundamental question concerning adversarial noise models in statistical problems where the algorithm receives i.i.d. draws from a distribution $\mathcal{D}$. The definitions of these adversaries specify the type of allowable corruptions (noise model) as well as when these corruptions can be made (adaptivity); the latter differentiates between oblivious adversaries that can only corrupt the distribution $\mathcal{D}$ and adaptive adversaries that can have their corruptions depend on the specific sample $S$ that is drawn from $\mathcal{D}$. In this work, we investigate whether oblivious adversaries are effectively equivalent to adaptive adversaries, across all noise models studied in the literature. Specifically, can the behavior of an algorithm $\mathcal{A}$ in the presence of oblivious adversaries always be well-approximated by that of an algorithm $\mathcal{A}'$ in the presence of adaptive adversaries? Our first result shows that this is indeed the case for the broad class of statistical query algorithms, under all reasonable noise models. We then show that in the specific case of additive noise, this equivalence holds for all algorithms. Finally, we map out an approach towards proving this statement in its fullest generality, for all algorithms and under all reasonable noise models.

The large majority of human activities require collaborations within and across formal or informal teams. Our understanding of how the collaborative efforts spent by teams relate to their performance is still a matter of debate. Teamwork results in a highly interconnected ecosystem of potentially overlapping components where tasks are performed in interaction with team members and across other teams. To tackle this problem, we propose a graph neural network model designed to predict a team's performance while identifying the drivers that determine such an outcome. In particular, the model is based on three architectural channels: topological, centrality, and contextual which capture different factors potentially shaping teams' success. We endow the model with two attention mechanisms to boost model performance and allow interpretability. A first mechanism allows pinpointing key members inside the team. A second mechanism allows us to quantify the contributions of the three driver effects in determining the outcome performance. We test model performance on a wide range of domains outperforming most of the classical and neural baselines considered. Moreover, we include synthetic datasets specifically designed to validate how the model disentangles the intended properties on which our model vastly outperforms baselines.

Decision tree learning is a widely used approach in machine learning, favoured in applications that require concise and interpretable models. Heuristic methods are traditionally used to quickly produce models with reasonably high accuracy. A commonly criticised point, however, is that the resulting trees may not necessarily be the best representation of the data in terms of accuracy and size. In recent years, this motivated the development of optimal classification tree algorithms that globally optimise the decision tree in contrast to heuristic methods that perform a sequence of locally optimal decisions. We follow this line of work and provide a novel algorithm for learning optimal classification trees based on dynamic programming and search. Our algorithm supports constraints on the depth of the tree and number of nodes. The success of our approach is attributed to a series of specialised techniques that exploit properties unique to classification trees. Whereas algorithms for optimal classification trees have traditionally been plagued by high runtimes and limited scalability, we show in a detailed experimental study that our approach uses only a fraction of the time required by the state-of-the-art and can handle datasets with tens of thousands of instances, providing several orders of magnitude improvements and notably contributing towards the practical realisation of optimal decision trees.

Recent progress in \emph{Geometric Deep Learning} (GDL) has shown its potential to provide powerful data-driven models. This gives momentum to explore new methods for learning physical systems governed by \emph{Partial Differential Equations} (PDEs) from Graph-Mesh data. However, despite the efforts and recent achievements, several research directions remain unexplored and progress is still far from satisfying the physical requirements of real-world phenomena. One of the major impediments is the absence of benchmarking datasets and common physics evaluation protocols. In this paper, we propose a 2-D graph-mesh dataset to study the airflow over airfoils at high Reynolds regime (from $10^6$ and beyond). We also introduce metrics on the stress forces over the airfoil in order to evaluate GDL models on important physical quantities. Moreover, we provide extensive GDL baselines.

Pruning effectively compresses overparameterized models. Despite the success of pruning methods for discriminative models, applying them for generative models has been relatively rarely approached. This study conducts structured pruning on U-Net generators of conditional GANs. A per-layer sensitivity analysis confirms that many unnecessary filters exist in the innermost layers near the bottleneck and can be substantially pruned. Based on this observation, we prune these filters from multiple inner layers or suggest alternative architectures by completely eliminating the layers. We evaluate our approach with Pix2Pix for image-to-image translation and Wav2Lip for speech-driven talking face generation. Our method outperforms global pruning baselines, demonstrating the importance of properly considering where to prune for U-Net generators.

Recent works have tried to increase the verifiability of adversarially trained networks by running the attacks over domains larger than the original perturbations and adding various regularization terms to the objective. However, these algorithms either underperform or require complex and expensive stage-wise training procedures, hindering their practical applicability. We present IBP-R, a novel verified training algorithm that is both simple and effective. IBP-R induces network verifiability by coupling adversarial attacks on enlarged domains with a regularization term, based on inexpensive interval bound propagation, that minimizes the gap between the non-convex verification problem and its approximations. By leveraging recent branch-and-bound frameworks, we show that IBP-R obtains state-of-the-art verified robustness-accuracy trade-offs for small perturbations on CIFAR-10 while training significantly faster than relevant previous work. Additionally, we present UPB, a novel branching strategy that, relying on a simple heuristic based on $\beta$-CROWN, reduces the cost of state-of-the-art branching algorithms while yielding splits of comparable quality.

Synaptic memory consolidation has been heralded as one of the key mechanisms for supporting continual learning in neuromorphic Artificial Intelligence (AI) systems. Here we report that a Fowler-Nordheim (FN) quantum-tunneling device can implement synaptic memory consolidation similar to what can be achieved by algorithmic consolidation models like the cascade and the elastic weight consolidation (EWC) models. The proposed FN-synapse not only stores the synaptic weight but also stores the synapse's historical usage statistic on the device itself. We also show that the operation of the FN-synapse is near-optimal in terms of the synaptic lifetime and we demonstrate that a network comprising FN-synapses outperforms a comparable EWC network for a small benchmark continual learning task. With an energy footprint of femtojoules per synaptic update, we believe that the proposed FN-synapse provides an ultra-energy-efficient approach for implementing both synaptic memory consolidation and persistent learning.

The minimization of a data-fidelity term and an additive regularization functional gives rise to a powerful framework for supervised learning. In this paper, we present a unifying regularization functional that depends on an operator and on a generic Radon-domain norm. We establish the existence of a minimizer and give the parametric form of the solution(s) under very mild assumptions. When the norm is Hilbertian, the proposed formulation yields a solution that involves radial-basis functions and is compatible with the classical methods of machine learning. By contrast, for the total-variation norm, the solution takes the form of a two-layer neural network with an activation function that is determined by the regularization operator. In particular, we retrieve the popular ReLU networks by letting the operator be the Laplacian. We also characterize the solution for the intermediate regularization norms $\|\cdot\|=\|\cdot\|_{L_p}$ with $p\in(1,2]$. Our framework offers guarantees of universal approximation for a broad family of regularization operators or, equivalently, for a wide variety of shallow neural networks, including the cases (such as ReLU) where the activation function is increasing polynomially. It also explains the favorable role of bias and skip connections in neural architectures.

We explore algorithms and limitations for sparse optimization problems such as sparse linear regression and robust linear regression. The goal of the sparse linear regression problem is to identify a small number of key features, while the goal of the robust linear regression problem is to identify a small number of erroneous measurements. Specifically, the sparse linear regression problem seeks a $k$-sparse vector $x\in\mathbb{R}^d$ to minimize $\|Ax-b\|_2$, given an input matrix $A\in\mathbb{R}^{n\times d}$ and a target vector $b\in\mathbb{R}^n$, while the robust linear regression problem seeks a set $S$ that ignores at most $k$ rows and a vector $x$ to minimize $\|(Ax-b)_S\|_2$. We first show bicriteria, NP-hardness of approximation for robust regression building on the work of [OWZ15] which implies a similar result for sparse regression. We further show fine-grained hardness of robust regression through a reduction from the minimum-weight $k$-clique conjecture. On the positive side, we give an algorithm for robust regression that achieves arbitrarily accurate additive error and uses runtime that closely matches the lower bound from the fine-grained hardness result, as well as an algorithm for sparse regression with similar runtime. Both our upper and lower bounds rely on a general reduction from robust linear regression to sparse regression that we introduce. Our algorithms, inspired by the 3SUM problem, use approximate nearest neighbor data structures and may be of independent interest for solving sparse optimization problems. For instance, we demonstrate that our techniques can also be used for the well-studied sparse PCA problem.

Transformer-based models have been widely used and achieved state-of-the-art performance in various domains such as natural language processing and computer vision. Recent works show that Transformers can also be generalized to graph-structured data. However, the success is limited to small-scale graphs due to technical challenges such as the quadratic complexity in regards to the number of nodes and non-local aggregation that often leads to inferior generalization performance to conventional graph neural networks. In this paper, to address these issues, we propose Deformable Graph Transformer (DGT) that performs sparse attention with dynamically sampled key and value pairs. Specifically, our framework first constructs multiple node sequences with various criteria to consider both structural and semantic proximity. Then, the sparse attention is applied to the node sequences for learning node representations with a reduced computational cost. We also design simple and effective positional encodings to capture structural similarity and distance between nodes. Experiments demonstrate that our novel graph Transformer consistently outperforms existing Transformer-based models and shows competitive performance compared to state-of-the-art models on 8 graph benchmark datasets including large-scale graphs.

We consider the problem of personalised news recommendation where each user consumes news in a sequential fashion. Existing personalised news recommendation methods focus on exploiting user interests and ignores exploration in recommendation, which leads to biased feedback loops and hurt recommendation quality in the long term. We build on contextual bandits recommendation strategies which naturally address the exploitation-exploration trade-off. The main challenges are the computational efficiency for exploring the large-scale item space and utilising the deep representations with uncertainty. We propose a two-stage hierarchical topic-news deep contextual bandits framework to efficiently learn user preferences when there are many news items. We use deep learning representations for users and news, and generalise the neural upper confidence bound (UCB) policies to generalised additive UCB and bilinear UCB. Empirical results on a large-scale news recommendation dataset show that our proposed policies are efficient and outperform the baseline bandit policies.

By filling in missing values in datasets, imputation allows these datasets to be used with algorithms that cannot handle missing values by themselves. However, missing values may in principle contribute useful information that is lost through imputation. The missing-indicator approach can be used in combination with imputation to instead represent this information as a part of the dataset. There are several theoretical considerations why missing-indicators may or may not be beneficial, but there has not been any large-scale practical experiment on real-life datasets to test this question for machine learning predictions. We perform this experiment for three imputation strategies and a range of different classification algorithms, on the basis of twenty real-life datasets. We find that on these datasets, missing-indicators generally increase classification performance. In addition, we find no evidence for most algorithms that nearest neighbour and iterative imputation lead to better performance than simple mean/mode imputation. Therefore, we recommend the use of missing-indicators with mean/mode imputation as a safe default, with the caveat that for decision trees, pruning is necessary to prevent overfitting. In a follow-up experiment, we determine attribute-specific missingness thresholds for each classifier above which missing-indicators are more likely than not to increase classification performance, and observe that these thresholds are much lower for categorical than for numerical attributes. Finally, we argue that mean imputation of numerical attributes may preserve some of the information from missing values, and we show that in the absence of missing-indicators, it can similarly be useful to apply mean imputation to one-hot encoded categorical attributes instead of mode imputation.

A kernel-based quantum classifier is the most interesting and powerful quantum machine learning technique for hyperlinear classification of complex data, which can be easily realized in shallow-depth quantum circuits such as a SWAP test classifier. Surprisingly, a support vector machine can be realized inherently and explicitly on these circuits by introduction of a variational scheme to map the quadratic optimization problem of the SVM theory to a quantum-classical variational optimization problem. This scheme is realized with parameterized quantum circuits (PQC) to create a nonuniform weight vector to index qubits that can evaluate training loss and classification score in a linear time. We train the classical parameters of this Variational Quantum Approximate Support Vector Machine (VQASVM), which can be transferred to many copies of other VQASVM decision inference circuits for classification of new query data. Our VQASVM algorithm is experimented with toy example data sets on cloud-based quantum machines for feasibility evaluation, and numerically investigated to evaluate its performance on a standard iris flower data set. The accuracy of iris data classification reached 98.8%.

Machine learning (ML) for diagnosis of thyroid nodules on ultrasound is an active area of research. However, ML tools require large, well-labelled datasets, the curation of which is time-consuming and labor-intensive. The purpose of our study was to develop and test a deep-learning-based tool to facilitate and automate the data annotation process for thyroid nodules; we named our tool Multistep Automated Data Labelling Procedure (MADLaP). MADLaP was designed to take multiple inputs included pathology reports, ultrasound images, and radiology reports. Using multiple step-wise modules including rule-based natural language processing, deep-learning-based imaging segmentation, and optical character recognition, MADLaP automatically identified images of a specific thyroid nodule and correctly assigned a pathology label. The model was developed using a training set of 378 patients across our health system and tested on a separate set of 93 patients. Ground truths for both sets were selected by an experienced radiologist. Performance metrics including yield (how many labeled images the model produced) and accuracy (percentage correct) were measured using the test set. MADLaP achieved a yield of 63% and an accuracy of 83%. The yield progressively increased as the input data moved through each module, while accuracy peaked part way through. Error analysis showed that inputs from certain examination sites had lower accuracy (40%) than the other sites (90%, 100%). MADLaP successfully created curated datasets of labeled ultrasound images of thyroid nodules. While accurate, the relatively suboptimal yield of MADLaP exposed some challenges when trying to automatically label radiology images from heterogeneous sources. The complex task of image curation and annotation could be automated, allowing for enrichment of larger datasets for use in machine learning development.

Due to the massive explanation of artificial intelligence, machine learning technology is being used in various areas of our day-to-day life. In the world, there are a lot of scenarios where a simple crime can be prevented before it may even happen or find the person responsible for it. A face is one distinctive feature that we have and can differentiate easily among many other species. But not just different species, it also plays a significant role in determining someone from the same species as us, humans. Regarding this critical feature, a single problem occurs most often nowadays. When the camera is pointed, it cannot detect a person's face, and it becomes a poor image. On the other hand, where there was a robbery and a security camera installed, the robber's identity is almost indistinguishable due to the low-quality camera. But just making an excellent algorithm to work and detecting a face reduces the cost of hardware, and it doesn't cost that much to focus on that area. Facial recognition, widget control, and such can be done by detecting the face correctly. This study aims to create and enhance a machine learning model that correctly recognizes faces. Total 627 Data have been collected from different Bangladeshi people's faces on four angels. In this work, CNN, Harr Cascade, Cascaded CNN, Deep CNN & MTCNN are these five machine learning approaches implemented to get the best accuracy of our dataset. After creating and running the model, Multi-Task Convolutional Neural Network (MTCNN) achieved 96.2% best model accuracy with training data rather than other machine learning models.

We present a statistical model for German medical natural language processing trained for named entity recognition (NER) as an open, publicly available model. The work serves as a refined successor to our first GERNERMED model which is substantially outperformed by our work. We demonstrate the effectiveness of combining multiple techniques in order to achieve strong results in entity recognition performance by the means of transfer-learning on pretrained deep language models (LM), word-alignment and neural machine translation. Due to the sparse situation on open, public medical entity recognition models for German texts, this work offers benefits to the German research community on medical NLP as a baseline model. Since our model is based on public English data, its weights are provided without legal restrictions on usage and distribution. The sample code and the statistical model is available at: https://github.com/frankkramer-lab/GERNERMED-pp

In this report, we present our approach for EPIC-KITCHENS-100 Multi-Instance Retrieval Challenge 2022. We first parse sentences into semantic roles corresponding to verbs and nouns; then utilize self-attentions to exploit semantic role contextualized video features along with textual features via triplet losses in multiple embedding spaces. Our method overpasses the strong baseline in normalized Discounted Cumulative Gain (nDCG), which is more valuable for semantic similarity. Our submission is ranked 3rd for nDCG and ranked 4th for mAP.

Understanding public discourse on emergency use of unproven therapeutics is essential to monitor safe use and combat misinformation. We developed a natural language processing (NLP)-based pipeline to understand public perceptions of and stances on COVID-19-related drugs on Twitter across time. This retrospective study included 609,189 US-based tweets between January 29th, 2020 and November 30th, 2021 on four drugs that gained wide public attention during the COVID-19 pandemic: 1) Hydroxychloroquine and Ivermectin, drug therapies with anecdotal evidence; and 2) Molnupiravir and Remdesivir, FDA-approved treatment options for eligible patients. Time-trend analysis was used to understand the popularity and related events. Content and demographic analyses were conducted to explore potential rationales of people's stances on each drug. Time-trend analysis revealed that Hydroxychloroquine and Ivermectin received much more discussion than Molnupiravir and Remdesivir, particularly during COVID-19 surges. Hydroxychloroquine and Ivermectin were highly politicized, related to conspiracy theories, hearsay, celebrity effects, etc. The distribution of stance between the two major US political parties was significantly different (p<0.001); Republicans were much more likely to support Hydroxychloroquine (+55%) and Ivermectin (+30%) than Democrats. People with healthcare backgrounds tended to oppose Hydroxychloroquine (+7%) more than the general population; in contrast, the general population was more likely to support Ivermectin (+14%). We make all the data, code, and models available at https://github.com/ningkko/COVID-drug.

In this article we propose and validate an unsupervised probabilistic model, Gaussian Latent Dirichlet Allocation (GLDA), for the problem of discrete state discovery from repeated, multivariate psychophysiological samples collected from multiple, inherently distinct, individuals. Psychology and medical research heavily involves measuring potentially related but individually inconclusive variables from a cohort of participants to derive diagnosis, necessitating clustering analysis. Traditional probabilistic clustering models such as Gaussian Mixture Model (GMM) assume a global mixture of component distributions, which may not be realistic for observations from different patients. The GLDA model borrows the individual-specific mixture structure from a popular topic model Latent Dirichlet Allocation (LDA) in Natural Language Processing and merges it with the Gaussian component distributions of GMM to suit continuous type data. We implemented GLDA using STAN (a probabilistic modeling language) and applied it on two datasets, one containing Ecological Momentary Assessments (EMA) and the other heart measures from electrocardiogram and impedance cardiograph. We found that in both datasets the GLDA-learned class weights achieved significantly higher correlations with clinically assessed depression, anxiety, and stress scores than those produced by the baseline GMM. Our findings demonstrate the advantage of GLDA over conventional finite mixture models for human state discovery from repeated multivariate data, likely due to better characterization of potential underlying between-participant differences. Future work is required to validate the utility of this model on a broader range of applications.  ( 3 min )

We show that the effectiveness of the well celebrated Mixup [Zhang et al., 2018] can be further improved if instead of using it as the sole learning objective, it is utilized as an additional regularizer to the standard cross-entropy loss. This simple change not only provides much improved accuracy but also significantly improves the quality of the predictive uncertainty estimation of Mixup in most cases under various forms of covariate shifts and out-of-distribution detection experiments. In fact, we observe that Mixup yields much degraded performance on detecting out-of-distribution samples possibly, as we show empirically, because of its tendency to learn models that exhibit high-entropy throughout; making it difficult to differentiate in-distribution samples from out-distribution ones. To show the efficacy of our approach (RegMixup), we provide thorough analyses and experiments on vision datasets (ImageNet & CIFAR-10/100) and compare it with a suite of recent approaches for reliable uncertainty estimation.  ( 2 min )

We introduce a novel, practically relevant variation of the anomaly detection problem in multi-variate time series: intrinsic anomaly detection. It appears in diverse practical scenarios ranging from DevOps to IoT, where we want to recognize failures of a system that operates under the influence of a surrounding environment. Intrinsic anomalies are changes in the functional dependency structure between time series that represent an environment and time series that represent the internal state of a system that is placed in said environment. We formalize this problem, provide under-studied public and new purpose-built data sets for it, and present methods that handle intrinsic anomaly detection. These address the short-coming of existing anomaly detection methods that cannot differentiate between expected changes in the system's state and unexpected ones, i.e., changes in the system that deviate from the environment's influence. Our most promising approach is fully unsupervised and combines adversarial learning and time series representation learning, thereby addressing problems such as label sparsity and subjectivity, while allowing to navigate and improve notoriously problematic anomaly detection data sets.

In this paper, we propose a probabilistic model with automatic relevance determination (ARD) for learning interpolative decomposition (ID), which is commonly used for low-rank approximation, feature selection, and identifying hidden patterns in data, where the matrix factors are latent variables associated with each data dimension. Prior densities with support on the specified subspace are used to address the constraint for the magnitude of the factored component of the observed matrix. Bayesian inference procedure based on Gibbs sampling is employed. We evaluate the model on a variety of real-world datasets including CCLE $EC50$, CCLE $IC50$, Gene Body Methylation, and Promoter Methylation datasets with different sizes, and dimensions, and show that the proposed Bayesian ID algorithms with automatic relevance determination lead to smaller reconstructive errors even compared to vanilla Bayesian ID algorithms with fixed latent dimension set to matrix rank.

In this study, we address the problem of efficient exploration in reinforcement learning. Most common exploration approaches depend on random action selection, however these approaches do not work well in environments with sparse or no rewards. We propose Generative Adversarial Network-based Intrinsic Reward Module that learns the distribution of the observed states and sends an intrinsic reward that is computed as high for states that are out of distribution, in order to lead agent to unexplored states. We evaluate our approach in Super Mario Bros for a no reward setting and in Montezuma's Revenge for a sparse reward setting and show that our approach is indeed capable of exploring efficiently. We discuss a few weaknesses and conclude by discussing future works.  ( 2 min )

There is an increase in deploying Deep Learning (DL)-based software systems in real-world applications. Usually DL models are developed and trained using DL frameworks that have their own internal mechanisms/formats to represent and train DL models, and usually those formats cannot be recognized by other frameworks. Moreover, trained models are usually deployed in environments different from where they were developed. To solve the interoperability issue and make DL models compatible with different frameworks/environments, some exchange formats are introduced for DL models, like ONNX and CoreML. However, ONNX and CoreML were never empirically evaluated by the community to reveal their prediction accuracy, performance, and robustness after conversion. Poor accuracy or non-robust behavior of converted models may lead to poor quality of deployed DL-based software systems. We conduct, in this paper, the first empirical study to assess ONNX and CoreML for converting trained DL models. In our systematic approach, two popular DL frameworks, Keras and PyTorch, are used to train five widely used DL models on three popular datasets. The trained models are then converted to ONNX and CoreML and transferred to two runtime environments designated for such formats, to be evaluated. We investigate the prediction accuracy before and after conversion. Our results unveil that the prediction accuracy of converted models are at the same level of originals. The performance (time cost and memory consumption) of converted models are studied as well. The size of models are reduced after conversion, which can result in optimized DL-based software deployment. Converted models are generally assessed as robust at the same level of originals. However, obtained results show that CoreML models are more vulnerable to adversarial attacks compared to ONNX.

Since February 2020, the world has been engaged in an intense struggle with the COVID-19 dis-ease, and health systems have come under tragic pressure as the disease turned into a pandemic. The aim of this study is to obtain the most effective routine blood values (RBV) in the diagnosis and prognosis of COVID-19 using a backward feature elimination algorithm for the LogNNet reservoir neural network. The first dataset in the study consists of a total of 5296 patients with the same number of negative and positive COVID-19 tests. The LogNNet-model achieved the accuracy rate of 99.5% in the diagnosis of the disease with 46 features and the accuracy of 99.17% with only mean corpuscular hemoglobin concentration, mean corpuscular hemoglobin, and activated partial prothrombin time. The second dataset consists of a total of 3899 patients with a diagnosis of COVID-19 who were treated in hospital, of which 203 were severe patients and 3696 were mild patients. The model reached the accuracy rate of 94.4% in determining the prognosis of the disease with 48 features and the accuracy of 82.7% with only erythrocyte sedimentation rate, neutrophil count, and C reactive protein features. Our method will reduce the negative pressures on the health sector and help doctors to understand the pathogenesis of COVID-19 using the key features. The method is promising to create mobile health monitoring systems in the Internet of Things.  ( 3 min )

This paper presents a novel nearest neighbor search algorithm achieving TPU (Google Tensor Processing Unit) peak performance, outperforming state-of-the-art GPU algorithms with similar level of recall. The design of the proposed algorithm is motivated by an accurate accelerator performance model that takes into account both the memory and instruction bottlenecks. Our algorithm comes with an analytical guarantee of recall in expectation and does not require maintaining sophisticated index data structure or tuning, making it suitable for applications with frequent updates. Our work is available in the open-source package of Jax and Tensorflow on TPU.

Scientists increasingly rely on Python tools to perform scalable distributed memory array operations using rich, NumPy-like expressions. However, many of these tools rely on dynamic schedulers optimized for abstract task graphs, which often encounter memory and network bandwidth-related bottlenecks due to sub-optimal data and operator placement decisions. Tools built on the message passing interface (MPI), such as ScaLAPACK and SLATE, have better scaling properties, but these solutions require specialized knowledge to use. In this work, we present NumS, an array programming library which optimizes NumPy-like expressions on task-based distributed systems. This is achieved through a novel scheduler called Load Simulated Hierarchical Scheduling (LSHS). LSHS is a local search method which optimizes operator placement by minimizing maximum memory and network load on any given node within a distributed system. Coupled with a heuristic for load balanced data layouts, our approach is capable of attaining communication lower bounds on some common numerical operations, and our empirical study shows that LSHS enhances performance on Ray by decreasing network load by a factor of 2x, requiring 4x less memory, and reducing execution time by 10x on the logistic regression problem. On terabyte-scale data, NumS achieves competitive performance to SLATE on DGEMM, up to 20x speedup over Dask on a key operation for tensor factorization, and a 2x speedup on logistic regression compared to Dask ML and Spark's MLlib.  ( 3 min )

This paper studies the problem of forecasting general stochastic processes using an extension of the Neural Jump ODE (NJ-ODE) framework. While NJ-ODE was the first framework to establish convergence guarantees for the prediction of irregularly observed time-series, these results were limited to data stemming from It\^o-diffusions with complete observations, in particular Markov processes where all coordinates are observed simultaneously. In this work, we generalise these results to generic, possibly non-Markovian or discontinuous, stochastic processes with incomplete observations, by utilising the reconstruction properties of the signature transform. These theoretical results are supported by empirical studies, where it is shown that the path-dependent NJ-ODE outperforms the original NJ-ODE framework in the case of non-Markovian data.

Personalisation of products and services is fast becoming the driver of success in banking and commerce. Machine learning holds the promise of gaining a deeper understanding of and tailoring to customers' needs and preferences. Whereas traditional solutions to financial decision problems frequently rely on model assumptions, reinforcement learning is able to exploit large amounts of data to improve customer modelling and decision-making in complex financial environments with fewer assumptions. Model explainability and interpretability present challenges from a regulatory perspective which demands transparency for acceptance; they also offer the opportunity for improved insight into and understanding of customers. Post-hoc approaches are typically used for explaining pretrained reinforcement learning models. Based on our previous modeling of customer spending behaviour, we adapt our recent reinforcement learning algorithm that intrinsically characterizes desirable behaviours and we transition to the problem of asset management. We train inherently interpretable reinforcement learning agents to give investment advice that is aligned with prototype financial personality traits which are combined to make a final recommendation. We observe that the trained agents' advice adheres to their intended characteristics, they learn the value of compound growth, and, without any explicit reference, the notion of risk as well as improved policy convergence.  ( 3 min )

The policy gradient theorem (Sutton et al., 2000) prescribes the usage of a cumulative discounted state distribution under the target policy to approximate the gradient. Most algorithms based on this theorem, in practice, break this assumption, introducing a distribution shift that can cause the convergence to poor solutions. In this paper, we propose a new approach of reconstructing the policy gradient from the start state without requiring a particular sampling strategy. The policy gradient calculation in this form can be simplified in terms of a gradient critic, which can be recursively estimated due to a new Bellman equation of gradients. By using temporal-difference updates of the gradient critic from an off-policy data stream, we develop the first estimator that sidesteps the distribution shift issue in a model-free way. We prove that, under certain realizability conditions, our estimator is unbiased regardless of the sampling strategy. We empirically show that our technique achieves a superior bias-variance trade-off and performance in presence of off-policy samples.  ( 2 min )

Deploying deep learning models in time-critical applications with limited computational resources, for instance in edge computing systems and IoT networks, is a challenging task that often relies on dynamic inference methods such as early exiting. In this paper, we introduce a novel architecture for early exiting based on the vision transformer architecture, as well as a fine-tuning strategy that significantly increase the accuracy of early exit branches compared to conventional approaches while introducing less overhead. Through extensive experiments on image and audio classification as well as audiovisual crowd counting, we show that our method works for both classification and regression problems, and in both single- and multi-modal settings. Additionally, we introduce a novel method for integrating audio and visual modalities within early exits in audiovisual data analysis, that can lead to a more fine-grained dynamic inference.  ( 2 min )

Scientific collaborations benefit from collaborative learning of distributed sources, but remain difficult to achieve when data are sensitive. In recent years, privacy preserving techniques have been widely studied to analyze distributed data across different agencies while protecting sensitive information. Most existing privacy preserving techniques are designed to resist semi-honest adversaries and require intense computation to perform data analysis. Secure collaborative learning is significantly difficult with the presence of malicious adversaries who may deviates from the secure protocol. Another challenge is to maintain high computation efficiency with privacy protection. In this paper, matrix encryption is applied to encrypt data such that the secure schemes are against malicious adversaries, including chosen plaintext attack, known plaintext attack, and collusion attack. The encryption scheme also achieves local differential privacy. Moreover, cross validation is studied to prevent overfitting without additional communication cost. Empirical experiments on real-world datasets demonstrate that the proposed schemes are computationally efficient compared to existing techniques against malicious adversary and semi-honest model.  ( 2 min )

Autoencoders have been widely used as a nonlinear tool for data dimensionality reduction. While autoencoders don't utilize the label information, Centroid-Encoders (CE)\cite{ghosh2022supervised} use the class label in their learning process. In this study, we propose a sparse optimization using the Centroid-Encoder architecture to determine a minimal set of features that discriminate between two or more classes. The resulting algorithm, Sparse Centroid-Encoder (SCE), extracts discriminatory features in groups using a sparsity inducing $\ell_1$-norm while mapping a point to its class centroid. One key attribute of SCE is that it can extract informative features from a multi-modal data set, i.e., data sets whose classes appear to have multiple clusters. The algorithm is applied to a wide variety of real world data sets, including single-cell data, high dimensional biological data, image data, speech data, and accelerometer sensor data. We compared our method to various state-of-the-art feature selection techniques, including supervised Concrete Autoencoders (SCAE), Feature Selection Network (FsNet), deep feature selection (DFS), Stochastic Gate (STG), and LassoNet. We empirically showed that SCE features often produced better classification accuracy than other methods on sequester test set.  ( 3 min )

The use of deep learning for electroencephalography (EEG) classification tasks has been rapidly growing in the last years, yet its application has been limited by the relatively small size of EEG datasets. Data augmentation, which consists in artificially increasing the size of the dataset during training, has been a key ingredient to obtain state-of-the-art performances across applications such as computer vision or speech. While a few augmentation transformations for EEG data have been proposed in the literature, their positive impact on performance across tasks remains elusive. In this work, we propose a unified and exhaustive analysis of the main existing EEG augmentations, which are compared in a common experimental setting. Our results highlight the best data augmentations to consider for sleep stage classification and motor imagery brain computer interfaces, showing predictive power improvements greater than 10% in some cases.  ( 2 min )

Visual model-based reinforcement learning (RL) has the potential to enable sample-efficient robot learning from visual observations. Yet the current approaches typically train a single model end-to-end for learning both visual representations and dynamics, making it difficult to accurately model the interaction between robots and small objects. In this work, we introduce a visual model-based RL framework that decouples visual representation learning and dynamics learning. Specifically, we train an autoencoder with convolutional layers and vision transformers (ViT) to reconstruct pixels given masked convolutional features, and learn a latent dynamics model that operates on the representations from the autoencoder. Moreover, to encode task-relevant information, we introduce an auxiliary reward prediction objective for the autoencoder. We continually update both autoencoder and dynamics model using online samples collected from environment interaction. We demonstrate that our decoupling approach achieves state-of-the-art performance on a variety of visual robotic tasks from Meta-world and RLBench, e.g., we achieve 81.7% success rate on 50 visual robotic manipulation tasks from Meta-world, while the baseline achieves 67.9%. Code is available on the project website: https://sites.google.com/view/mwm-rl.  ( 2 min )

Due to the over-smoothing issue, most existing graph neural networks can only capture limited dependencies with their inherently finite aggregation layers. To overcome this limitation, we propose a new kind of graph convolution, called Graph Implicit Nonlinear Diffusion (GIND), which implicitly has access to infinite hops of neighbors while adaptively aggregating features with nonlinear diffusion to prevent over-smoothing. Notably, we show that the learned representation can be formalized as the minimizer of an explicit convex optimization objective. With this property, we can theoretically characterize the equilibrium of our GIND from an optimization perspective. More interestingly, we can induce new structural variants by modifying the corresponding optimization objective. To be specific, we can embed prior properties to the equilibrium, as well as introducing skip connections to promote training stability. Extensive experiments show that GIND is good at capturing long-range dependencies, and performs well on both homophilic and heterophilic graphs with nonlinear diffusion. Moreover, we show that the optimization-induced variants of our models can boost the performance and improve training stability and efficiency as well. As a result, our GIND obtains significant improvements on both node-level and graph-level tasks.  ( 2 min )

Signature-based techniques give mathematical insight into the interactions between complex streams of evolving data. These insights can be quite naturally translated into numerical approaches to understanding streamed data, and perhaps because of their mathematical precision, have proved useful in analysing streamed data in situations where the data is irregular, and not stationary, and the dimension of the data and the sample sizes are both moderate. Understanding streamed multi-modal data is exponential: a word in $n$ letters from an alphabet of size $d$ can be any one of $d^n$ messages. Signatures remove the exponential amount of noise that arises from sampling irregularity, but an exponential amount of information still remain. This survey aims to stay in the domain where that exponential scaling can be managed directly. Scalability issues are an important challenge in many problems but would require another survey article and further ideas. This survey describes a range of contexts where the data sets are small enough to remove the possibility of massive machine learning, and the existence of small sets of context free and principled features can be used effectively. The mathematical nature of the tools can make their use intimidating to non-mathematicians. The examples presented in this article are intended to bridge this communication gap and provide tractable working examples drawn from the machine learning context. Notebooks are available online for several of these examples. This survey builds on the earlier paper of Ilya Chevryev and Andrey Kormilitzin which had broadly similar aims at an earlier point in the development of this machinery. This article illustrates how the theoretical insights offered by signatures are simply realised in the analysis of application data in a way that is largely agnostic to the data type.  ( 3 min )

In this paper, we present a Model-Based Reinforcement Learning (MBRL) algorithm named \emph{Monte Carlo Probabilistic Inference for Learning COntrol} (MC-PILCO). The algorithm relies on Gaussian Processes (GPs) to model the system dynamics and on a Monte Carlo approach to estimate the policy gradient. This defines a framework in which we ablate the choice of the following components: (i) the selection of the cost function, (ii) the optimization of policies using dropout, (iii) an improved data efficiency through the use of structured kernels in the GP models. The combination of the aforementioned aspects affects dramatically the performance of MC-PILCO. Numerical comparisons in a simulated cart-pole environment show that MC-PILCO exhibits better data efficiency and control performance w.r.t. state-of-the-art GP-based MBRL algorithms. Finally, we apply MC-PILCO to real systems, considering in particular systems with partially measurable states. We discuss the importance of modeling both the measurement system and the state estimators during policy optimization. The effectiveness of the proposed solutions has been tested in simulation and on two real systems, a Furuta pendulum and a ball-and-plate rig.  ( 3 min )

We present a framework for visual action planning of complex manipulation tasks with high-dimensional state spaces, focusing on manipulation of deformable objects. We propose a Latent Space Roadmap (LSR) for task planning which is a graph-based structure globally capturing the system dynamics in a low-dimensional latent space. Our framework consists of three parts: (1) a Mapping Module (MM) that maps observations given in the form of images into a structured latent space extracting the respective states as well as generates observations from the latent states, (2) the LSR which builds and connects clusters containing similar states in order to find the latent plans between start and goal states extracted by MM, and (3) the Action Proposal Module that complements the latent plan found by the LSR with the corresponding actions. We present a thorough investigation of our framework on simulated box stacking and rope/box manipulation tasks, and a folding task executed on a real robot.  ( 2 min )

We study the mutual information between (certain summaries of) the output of a learning algorithm and its $n$ training data, conditional on a supersample of $n+1$ i.i.d. data from which the training data is chosen at random without replacement. These leave-one-out variants of the conditional mutual information (CMI) of an algorithm (Steinke and Zakynthinou, 2020) are also seen to control the mean generalization error of learning algorithms with bounded loss functions. For learning algorithms achieving zero empirical risk under 0-1 loss (i.e., interpolating algorithms), we provide an explicit connection between leave-one-out CMI and the classical leave-one-out error estimate of the risk. Using this connection, we obtain upper and lower bounds on risk in terms of the (evaluated) leave-one-out CMI. When the limiting risk is constant or decays polynomially, the bounds converge to within a constant factor of two. As an application, we analyze the population risk of the one-inclusion graph algorithm, a general-purpose transductive learning algorithm for VC classes in the realizable setting. Using leave-one-out CMI, we match the optimal bound for learning VC classes in the realizable setting, answering an open challenge raised by Steinke and Zakynthinou (2020). Finally, in order to understand the role of leave-one-out CMI in studying generalization, we place leave-one-out CMI in a hierarchy of measures, with a novel unconditional mutual information at the root. For 0-1 loss and interpolating learning algorithms, this mutual information is observed to be precisely the risk.  ( 3 min )

A need to understand and predict vehicles' behavior underlies both public and private goals in the transportation domain, including urban planning and management, ride-sharing services, and intelligent transportation systems. Individuals' preferences and intended destinations vary throughout the day, week, and year: for example, bars are most popular in the evenings, and beaches are most popular in the summer. Despite this principle, we note that recent studies on a popular benchmark dataset from Porto, Portugal have found, at best, only marginal improvements in predictive performance from incorporating temporal information. We propose an approach based on hypernetworks, a variant of meta-learning ("learning to learn") in which a neural network learns to change its own weights in response to an input. In our case, the weights responsible for destination prediction vary with the metadata, in particular the time, of the input trajectory. The time-conditioned weights notably improve the model's error relative to ablation studies and comparable prior work, and we confirm our hypothesis that knowledge of time should improve prediction of a vehicle's intended destination.  ( 2 min )

Post-processing ensemble prediction systems can improve weather forecasting, especially for extreme event prediction. In recent years, different machine learning models have been developed to improve the quality of the post-processing step. However, these models heavily rely on the data and generating such ensemble members requires multiple runs of numerical weather prediction models, at high computational cost. This paper introduces the ENS-10 dataset, consisting of ten ensemble members spread over 20 years (1998-2017). The ensemble members are generated by perturbing numerical weather simulations to capture the chaotic behavior of the Earth. To represent the three-dimensional state of the atmosphere, ENS-10 provides the most relevant atmospheric variables in 11 distinct pressure levels as well as the surface at 0.5-degree resolution. The dataset targets the prediction correction task at 48-hour lead time, which is essentially improving the forecast quality by removing the biases of the ensemble members. To this end, ENS-10 provides the weather variables for forecast lead times T=0, 24, and 48 hours (two data points per week). We provide a set of baselines for this task on ENS-10 and compare their performance in correcting the prediction of different weather variables. We also assess our baselines for predicting extreme events using our dataset. The ENS-10 dataset is available under the Creative Commons Attribution 4.0 International (CC BY 4.0) licence.  ( 3 min )

Representing physical signals at different scales is among the most challenging problems in engineering. Several multi-scale modeling tools have been developed to describe physical systems governed by \emph{Partial Differential Equations} (PDEs). These tools are at the crossroad of principled physical models and numerical schema. Recently, data-driven models have been introduced to speed-up the approximation of PDE solutions compared to numerical solvers. Among these recent data-driven methods, neural integral operators are a class that learn a mapping between function spaces. These functions are discretized on graphs (meshes) which are appropriate for modeling interactions in physical phenomena. In this work, we study three multi-resolution schema with integral kernel operators that can be approximated with \emph{Message Passing Graph Neural Networks} (MPGNNs). To validate our study, we make extensive MPGNNs experiments with well-chosen metrics considering steady and unsteady PDEs.  ( 2 min )

In this paper, we present a novel insider attack called Matryoshka, which employs an irrelevant scheduled-to-publish DNN model as a carrier model for covert transmission of multiple secret models which memorize the functionality of private ML data stored in local data centers. Instead of treating the parameters of the carrier model as bit strings and applying conventional steganography, we devise a novel parameter sharing approach which exploits the learning capacity of the carrier model for information hiding. Matryoshka simultaneously achieves: (i) High Capacity -- With almost no utility loss of the carrier model, Matryoshka can hide a 26x larger secret model or 8 secret models of diverse architectures spanning different application domains in the carrier model, neither of which can be done with existing steganography techniques; (ii) Decoding Efficiency -- once downloading the published carrier model, an outside colluder can exclusively decode the hidden models from the carrier model with only several integer secrets and the knowledge of the hidden model architecture; (iii) Effectiveness -- Moreover, almost all the recovered models have similar performance as if it were trained independently on the private data; (iv) Robustness -- Information redundancy is naturally implemented to achieve resilience against common post-processing techniques on the carrier before its publishing; (v) Covertness -- A model inspector with different levels of prior knowledge could hardly differentiate a carrier model from a normal model.

Score-based generative models (SGMs) are a recently proposed paradigm for deep generative tasks and now show the state-of-the-art sampling performance. It is known that the original SGM design solves the two problems of the generative trilemma: i) sampling quality, and ii) sampling diversity. However, the last problem of the trilemma was not solved, i.e., their training/sampling complexity is notoriously high. To this end, distilling SGMs into simpler models, e.g., generative adversarial networks (GANs), is gathering much attention currently. We present an enhanced distillation method, called straight-path interpolation GAN (SPI-GAN), which can be compared to the state-of-the-art shortcut-based distillation method, called denoising diffusion GAN (DD-GAN). However, our method corresponds to an extreme method that does not use any intermediate shortcut information of the reverse SDE path, in which case DD-GAN fails to obtain good results. Nevertheless, our straight-path interpolation method greatly stabilizes the overall training process. As a result, SPI-GAN is one of the best models in terms of the sampling quality/diversity/time for CIFAR-10, CelebA-HQ-256, and LSUN-Church-256.

This paper proposes a classification model for predicting the main activity of bitcoin addresses based on their balances. Since the balances are functions of time, we apply methods from functional data analysis; more specifically, the features of the proposed classification model are the functional principal components of the data. Classifying bitcoin addresses is a relevant problem for two main reasons: to understand the composition of the bitcoin market, and to identify addresses used for illicit activities. Although other bitcoin classifiers have been proposed, they focus primarily on network analysis rather than curve behavior. Our approach, on the other hand, does not require any network information for prediction. Furthermore, functional features have the advantage of being straightforward to build, unlike expert-built features. Results show improvement when combining functional features with scalar features, and similar accuracy for the models using those features separately, which points to the functional model being a good alternative when domain-specific knowledge is not available.  ( 2 min )

This paper proposes a new accelerated proximal Markov chain Monte Carlo (MCMC) methodology to perform Bayesian computation efficiently in imaging inverse problems. The proposed methodology is derived from the Langevin diffusion process and stems from tightly integrating two state-of-the-art proximal Langevin MCMC samplers, SK-ROCK and split Gibbs sampling (SGS), which employ distinctively different strategies to improve convergence speed. More precisely, we show how to integrate, at the level of the Langevin diffusion process, the proximal SK-ROCK sampler which is based on a stochastic Runge-Kutta-Chebyshev approximation of the diffusion, with the model augmentation and relaxation strategy that SGS exploits to speed up Bayesian computation at the expense of asymptotic bias. This leads to a new and faster proximal SK-ROCK sampler that combines the accelerated quality of the original SK-ROCK sampler with the computational benefits of augmentation and relaxation. Moreover, rather than viewing the augmented and relaxed model as an approximation of the target model, positioning relaxation in a bias-variance trade-off, we propose to regard the augmented and relaxed model as a generalisation of the target model. This then allows us to carefully calibrate the amount of relaxation in order to simultaneously improve the accuracy of the model (as measured by the model evidence) and the sampler's convergence speed. To achieve this, we derive an empirical Bayesian method to automatically estimate the optimal amount of relaxation by maximum marginal likelihood estimation. The proposed methodology is demonstrated with a range of numerical experiments related to image deblurring and inpainting, as well as with comparisons with alternative approaches from the state of the art.

In this work, we study the use of the Bellman equation as a surrogate objective for value prediction accuracy. While the Bellman equation is uniquely solved by the true value function over all state-action pairs, we find that the Bellman error (the difference between both sides of the equation) is a poor proxy for the accuracy of the value function. In particular, we show that (1) due to cancellations from both sides of the Bellman equation, the magnitude of the Bellman error is only weakly related to the distance to the true value function, even when considering all state-action pairs, and (2) in the finite data regime, the Bellman equation can be satisfied exactly by infinitely many suboptimal solutions. This means that the Bellman error can be minimized without improving the accuracy of the value function. We demonstrate these phenomena through a series of propositions, illustrative toy examples, and empirical analysis in standard benchmark domains.  ( 2 min )

In this work, we study the possibility of defending against data-poisoning attacks while training a shallow neural network in a regression setup. We focus on doing supervised learning for a class of depth-2 finite-width neural networks, which includes single-filter convolutional networks. In this class of networks, we attempt to learn the network weights in the presence of a malicious oracle doing stochastic, bounded and additive adversarial distortions on the true output during training. For the non-gradient stochastic algorithm that we construct, we prove worst-case near-optimal trade-offs among the magnitude of the adversarial attack, the weight approximation accuracy, and the confidence achieved by the proposed algorithm. As our algorithm uses mini-batching, we analyze how the mini-batch size affects convergence. We also show how to utilize the scaling of the outer layer weights to counter output-poisoning attacks depending on the probability of attack. Lastly, we give experimental evidence demonstrating how our algorithm outperforms stochastic gradient descent under different input data distributions, including instances of heavy-tailed distributions.  ( 2 min )

We introduce an estimator for distances in a compact Riemannian manifold M based on graph Laplacian estimates of the Laplace-Beltrami operator. We upper bound the l2-loss for the ratio of the estimator over the true manifold distance, or more precisely an approximation of manifold distance in non-commutative geometry (cf. [Connes and Suijelekom, 2020]), in terms of spectral errors in the graph Laplacian estimates and, implicitly, several geometric properties of the manifold. We consequently obtain a consistency result for the estimator for samples equidistributed from a strictly positive density on M and graph Laplacians which spectrally converge, in a suitable sense, to the Laplace-Beltrami operator. The estimator resembles, and in fact its convergence properties are derived from, a special case of the Kontorovic dual reformulation of Wasserstein distance known as Connes' Distance Formula.  ( 2 min )

Large pre-trained generative models are known to occasionally provide samples that may be undesirable for various reasons. The standard way to mitigate this is to re-train the models differently. In this work, we take a different, more compute-friendly approach and investigate how to post-edit a model after training so that it forgets certain kinds of samples. We provide three different algorithms for GANs that differ on how the samples to be forgotten are described. Extensive evaluations on real-world image datasets show that our algorithms are capable of forgetting data while retaining high generation quality at a fraction of the cost of full re-training.  ( 2 min )

Recent works have tried to increase the verifiability of adversarially trained networks by running the attacks over domains larger than the original perturbations and adding various regularization terms to the objective. However, these algorithms either underperform or require complex and expensive stage-wise training procedures, hindering their practical applicability. We present IBP-R, a novel verified training algorithm that is both simple and effective. IBP-R induces network verifiability by coupling adversarial attacks on enlarged domains with a regularization term, based on inexpensive interval bound propagation, that minimizes the gap between the non-convex verification problem and its approximations. By leveraging recent branch-and-bound frameworks, we show that IBP-R obtains state-of-the-art verified robustness-accuracy trade-offs for small perturbations on CIFAR-10 while training significantly faster than relevant previous work. Additionally, we present UPB, a novel branching strategy that, relying on a simple heuristic based on $\beta$-CROWN, reduces the cost of state-of-the-art branching algorithms while yielding splits of comparable quality.  ( 2 min )

In Bayesian structure learning, we are interested in inferring a distribution over the directed acyclic graph (DAG) structure of Bayesian networks, from data. Defining such a distribution is very challenging, due to the combinatorially large sample space, and approximations based on MCMC are often required. Recently, a novel class of probabilistic models, called Generative Flow Networks (GFlowNets), have been introduced as a general framework for generative modeling of discrete and composite objects, such as graphs. In this work, we propose to use a GFlowNet as an alternative to MCMC for approximating the posterior distribution over the structure of Bayesian networks, given a dataset of observations. Generating a sample DAG from this approximate distribution is viewed as a sequential decision problem, where the graph is constructed one edge at a time, based on learned transition probabilities. Through evaluation on both simulated and real data, we show that our approach, called DAG-GFlowNet, provides an accurate approximation of the posterior over DAGs, and it compares favorably against other methods based on MCMC or variational inference.  ( 2 min )

We study the problem of learning robust acoustic models in adverse environments, characterized by a significant mismatch between training and test conditions. This problem is of paramount importance for the deployment of speech recognition systems that need to perform well in unseen environments. First, we characterize data augmentation theoretically as an instance of vicinal risk minimization, which aims at improving risk estimates during training by replacing the delta functions that define the empirical density over the input space with an approximation of the marginal population density in the vicinity of the training samples. More specifically, we assume that local neighborhoods centered at training samples can be approximated using a mixture of Gaussians, and demonstrate theoretically that this can incorporate robust inductive bias into the learning process. We then specify the individual mixture components implicitly via data augmentation schemes, designed to address common sources of spurious correlations in acoustic models. To avoid potential confounding effects on robustness due to information loss, which has been associated with standard feature extraction techniques (e.g., FBANK and MFCC features), we focus on the waveform-based setting. Our empirical results show that the approach can generalize to unseen noise conditions, with 150% relative improvement in out-of-distribution generalization compared to training using the standard risk minimization principle. Moreover, the results demonstrate competitive performance relative to models learned using a training sample designed to match the acoustic conditions characteristic of test utterances.  ( 3 min )

Signature-based techniques give mathematical insight into the interactions between complex streams of evolving data. These insights can be quite naturally translated into numerical approaches to understanding streamed data, and perhaps because of their mathematical precision, have proved useful in analysing streamed data in situations where the data is irregular, and not stationary, and the dimension of the data and the sample sizes are both moderate. Understanding streamed multi-modal data is exponential: a word in $n$ letters from an alphabet of size $d$ can be any one of $d^n$ messages. Signatures remove the exponential amount of noise that arises from sampling irregularity, but an exponential amount of information still remain. This survey aims to stay in the domain where that exponential scaling can be managed directly. Scalability issues are an important challenge in many problems but would require another survey article and further ideas. This survey describes a range of contexts where the data sets are small enough to remove the possibility of massive machine learning, and the existence of small sets of context free and principled features can be used effectively. The mathematical nature of the tools can make their use intimidating to non-mathematicians. The examples presented in this article are intended to bridge this communication gap and provide tractable working examples drawn from the machine learning context. Notebooks are available online for several of these examples. This survey builds on the earlier paper of Ilya Chevryev and Andrey Kormilitzin which had broadly similar aims at an earlier point in the development of this machinery. This article illustrates how the theoretical insights offered by signatures are simply realised in the analysis of application data in a way that is largely agnostic to the data type.  ( 3 min )

Causal inference methods for treatment effect estimation usually assume independent experimental units. However, this assumption is often questionable because experimental units may interact. We develop augmented inverse probability weighting (AIPW) for estimation and inference of causal treatment effects on dependent observational data. Our framework covers very general cases of spillover effects induced by units interacting in networks. We use plugin machine learning to estimate infinite-dimensional nuisance components leading to a consistent treatment effect estimator that converges at the parametric rate and asymptotically follows a Gaussian distribution.  ( 2 min )

Physics-informed neural networks (PINNs) have become a popular choice for solving high-dimensional partial differential equations (PDEs) due to their excellent approximation power and generalization ability. Recently, Extended PINNs (XPINNs) based on domain decomposition methods have attracted considerable attention due to their effectiveness in modeling multiscale and multiphysics problems and their parallelization. However, theoretical understanding on their convergence and generalization properties remains unexplored. In this study, we take an initial step towards understanding how and when XPINNs outperform PINNs. Specifically, for general multi-layer PINNs and XPINNs, we first provide a prior generalization bound via the complexity of the target functions in the PDE problem, and a posterior generalization bound via the posterior matrix norms of the networks after optimization. Moreover, based on our bounds, we analyze the conditions under which XPINNs improve generalization. Concretely, our theory shows that the key building block of XPINN, namely the domain decomposition, introduces a tradeoff for generalization. On the one hand, XPINNs decompose the complex PDE solution into several simple parts, which decreases the complexity needed to learn each part and boosts generalization. On the other hand, decomposition leads to less training data being available in each subdomain, and hence such model is typically prone to overfitting and may become less generalizable. Empirically, we choose five PDEs to show when XPINNs perform better than, similar to, or worse than PINNs, hence demonstrating and justifying our new theory.  ( 3 min )

Decision tree learning is a widely used approach in machine learning, favoured in applications that require concise and interpretable models. Heuristic methods are traditionally used to quickly produce models with reasonably high accuracy. A commonly criticised point, however, is that the resulting trees may not necessarily be the best representation of the data in terms of accuracy and size. In recent years, this motivated the development of optimal classification tree algorithms that globally optimise the decision tree in contrast to heuristic methods that perform a sequence of locally optimal decisions. We follow this line of work and provide a novel algorithm for learning optimal classification trees based on dynamic programming and search. Our algorithm supports constraints on the depth of the tree and number of nodes. The success of our approach is attributed to a series of specialised techniques that exploit properties unique to classification trees. Whereas algorithms for optimal classification trees have traditionally been plagued by high runtimes and limited scalability, we show in a detailed experimental study that our approach uses only a fraction of the time required by the state-of-the-art and can handle datasets with tens of thousands of instances, providing several orders of magnitude improvements and notably contributing towards the practical realisation of optimal decision trees.  ( 3 min )

Widely observed neural scaling laws, in which error falls off as a power of the training set size, model size, or both, have driven substantial performance improvements in deep learning. However, these improvements through scaling alone require considerable costs in compute and energy. Here we focus on the scaling of error with dataset size and show how both in theory and practice we can break beyond power law scaling and reduce it to exponential scaling instead if we have access to a high-quality data pruning metric that ranks the order in which training examples should be discarded to achieve any pruned dataset size. We then test this new exponential scaling prediction with pruned dataset size empirically, and indeed observe better than power law scaling performance on ResNets trained on CIFAR-10, SVHN, and ImageNet. Given the importance of finding high-quality pruning metrics, we perform the first large-scale benchmarking study of ten different data pruning metrics on ImageNet. We find most existing high performing metrics scale poorly to ImageNet, while the best are computationally intensive and require labels for every image. We therefore developed a new simple, cheap and scalable self-supervised pruning metric that demonstrates comparable performance to the best supervised metrics. Overall, our work suggests that the discovery of good data-pruning metrics may provide a viable path forward to substantially improved neural scaling laws, thereby reducing the resource costs of modern deep learning.  ( 3 min )

We discuss the prediction accuracy of assumed statistical models in terms of prediction errors for the generalized linear model and penalized maximum likelihood methods. We derive the forms of estimators for the prediction errors: $C_p$ criterion, information criteria, and leave-one-out cross validation (LOOCV) error, using the generalized approximate message passing (GAMP) algorithm and replica method. These estimators coincide with each other when the number of model parameters is sufficiently small; however, there is a discrepancy between them in particular in the overparametrized region where the number of model parameters is larger than the data dimension. In this paper, we review the prediction errors and corresponding estimators, and discuss their differences. In the framework of GAMP, we show that the information criteria can be expressed by using the variance of the estimates. Further, we demonstrate how to approach LOOCV error from the information criteria by utilizing the expression provided by GAMP.  ( 2 min )

Scientific collaborations benefit from collaborative learning of distributed sources, but remain difficult to achieve when data are sensitive. In recent years, privacy preserving techniques have been widely studied to analyze distributed data across different agencies while protecting sensitive information. Most existing privacy preserving techniques are designed to resist semi-honest adversaries and require intense computation to perform data analysis. Secure collaborative learning is significantly difficult with the presence of malicious adversaries who may deviates from the secure protocol. Another challenge is to maintain high computation efficiency with privacy protection. In this paper, matrix encryption is applied to encrypt data such that the secure schemes are against malicious adversaries, including chosen plaintext attack, known plaintext attack, and collusion attack. The encryption scheme also achieves local differential privacy. Moreover, cross validation is studied to prevent overfitting without additional communication cost. Empirical experiments on real-world datasets demonstrate that the proposed schemes are computationally efficient compared to existing techniques against malicious adversary and semi-honest model.  ( 2 min )

When observations are truncated, we are limited to an incomplete picture of our dataset. Recent methods deal with truncated density estimation problems by turning to score matching, where the access to the intractable normalising constant is not required. We present a novel extension to truncated score matching for a Riemannian manifold. Applications are presented for the von Mises-Fisher and Kent distributions on a two dimensional sphere in $\R^3$, as well as a real-world application of extreme storm observations in the USA. In simulated data experiments, our score matching estimator is able to approximate the true parameter values with a low estimation error and shows improvements over a maximum likelihood estimator.  ( 2 min )

We propose cKAM, cyclical Kernel Adaptive Metropolis, which incorporates a cyclical stepsize scheme to allow control for exploration and sampling. We show that on a crafted bimodal distribution, existing Adaptive Metropolis type algorithms would fail to converge to the true posterior distribution. We point out that this is because adaptive samplers estimates the local/global covariance structure using past history of the chain, which will lead to adaptive algorithms be trapped in a local mode. We demonstrate that cKAM encourages exploration of the posterior distribution and allows the sampler to escape from a local mode, while maintaining the high performance of adaptive methods.  ( 2 min )

By inferring latent groups in the training data, recent works introduce invariant learning to the case where environment annotations are unavailable. Typically, learning group invariance under a majority/minority split is empirically shown to be effective in improving out-of-distribution generalization on many datasets. However, theoretical guarantee for these methods on learning invariant mechanisms is lacking. In this paper, we reveal the insufficiency of existing group invariant learning methods in preventing classifiers from depending on spurious correlations in the training set. Specifically, we propose two criteria on judging such sufficiency. Theoretically and empirically, we show that existing methods can violate both criteria and thus fail in generalizing to spurious correlation shifts. Motivated by this, we design a new group invariant learning method, which constructs groups with statistical independence tests, and reweights samples by group label proportion to meet the criteria. Experiments on both synthetic and real data demonstrate that the new method significantly outperforms existing group invariant learning methods in generalizing to spurious correlation shifts.  ( 2 min )

Reinforcement learning algorithms require many samples when solving complex hierarchical tasks with sparse and delayed rewards. For such complex tasks, the recently proposed RUDDER uses reward redistribution to leverage steps in the Q-function that are associated with accomplishing sub-tasks. However, often only few episodes with high rewards are available as demonstrations since current exploration strategies cannot discover them in reasonable time. In this work, we introduce Align-RUDDER, which utilizes a profile model for reward redistribution that is obtained from multiple sequence alignment of demonstrations. Consequently, Align-RUDDER employs reward redistribution effectively and, thereby, drastically improves learning on few demonstrations. Align-RUDDER outperforms competitors on complex artificial tasks with delayed rewards and few demonstrations. On the Minecraft ObtainDiamond task, Align-RUDDER is able to mine a diamond, though not frequently. Code is available at https://github.com/ml-jku/align-rudder. YouTube: https://youtu.be/HO-_8ZUl-UY  ( 2 min )

Many generative models synthesize data by transforming a standard Gaussian random variable using a deterministic neural network. Among these models are the Variational Autoencoders and the Generative Adversarial Networks. In this work, we call them "push-forward" models and study their expressivity. We show that the Lipschitz constant of these generative networks has to be large in order to fit multimodal distributions. More precisely, we show that the total variation distance and the Kullback-Leibler divergence between the generated and the data distribution are bounded from below by a constant depending on the mode separation and the Lipschitz constant. Since constraining the Lipschitz constants of neural networks is a common way to stabilize generative models, there is a provable trade-off between the ability of push-forward models to approximate multimodal distributions and the stability of their training. We validate our findings on one-dimensional and image datasets and empirically show that generative models consisting of stacked networks with stochastic input at each step, such as diffusion models do not suffer of such limitations.  ( 2 min )

We investigate an auto-regressive formulation for the problem of smoothing time-series by manipulating the inherent objective function of the traditional moving mean smoothers. Not only the auto-regressive smoothers enforce a higher degree of smoothing, they are just as efficient as the traditional moving means and can be optimized accordingly with respect to the input dataset. Interestingly, the auto-regressive models result in moving means with exponentially tapered windows.  ( 2 min )

Linear systems occur throughout engineering and the sciences, most notably as differential equations. In many cases the forcing function for the system is unknown, and interest lies in using noisy observations of the system to infer the forcing, as well as other unknown parameters. In differential equations, the forcing function is an unknown function of the independent variables (typically time and space), and can be modelled as a Gaussian process (GP). In this paper we show how the adjoint of a linear system can be used to efficiently infer forcing functions modelled as GPs, using a truncated basis expansion of the GP kernel. We show how exact conjugate Bayesian inference for the truncated GP can be achieved, in many cases with substantially lower computation than would be required using MCMC methods. We demonstrate the approach on systems of both ordinary and partial differential equations, and show that the basis expansion approach approximates well the true forcing with a modest number of basis vectors. Finally, we show how to infer point estimates for the non-linear model parameters, such as the kernel length-scales, using Bayesian optimisation.  ( 2 min )

Users have the right to have their data deleted by third-party learned systems, as codified by recent legislation such as the General Data Protection Regulation (GDPR) and the California Consumer Privacy Act (CCPA). Such data deletion can be accomplished by full re-training, but this incurs a high computational cost for modern machine learning models. To avoid this cost, many approximate data deletion methods have been developed for supervised learning. Unsupervised learning, in contrast, remains largely an open problem when it comes to (approximate or exact) efficient data deletion. In this paper, we propose a density-ratio-based framework for generative models. Using this framework, we introduce a fast method for approximate data deletion and a statistical test for estimating whether or not training points have been deleted. We provide theoretical guarantees under various learner assumptions and empirically demonstrate our methods across a variety of generative methods.  ( 2 min )

The authors recently gave an $n^{O(\log\log n)}$ time membership query algorithm for properly learning decision trees under the uniform distribution (Blanc et al., 2021). The previous fastest algorithm for this problem ran in $n^{O(\log n)}$ time, a consequence of Ehrenfeucht and Haussler (1989)'s classic algorithm for the distribution-free setting. In this article we highlight the natural open problem of obtaining a polynomial-time algorithm, discuss possible avenues towards obtaining it, and state intermediate milestones that we believe are of independent interest.  ( 2 min )

This paper derives a perturbation bound on the optimal subspace estimator obtained from a subset of its canonical projections contaminated by noise. This fundamental result has important implications in matrix completion, subspace clustering, and related problems.  ( 2 min )

A key challenge in science and engineering is to design experiments to learn about some unknown quantity of interest. Classical experimental design optimally allocates the experimental budget to maximize a notion of utility (e.g., reduction in uncertainty about the unknown quantity). We consider a rich setting, where the experiments are associated with states in a {\em Markov chain}, and we can only choose them by selecting a {\em policy} controlling the state transitions. This problem captures important applications, from exploration in reinforcement learning to spatial monitoring tasks. We propose an algorithm -- \textsc{markov-design} -- that efficiently selects policies whose measurement allocation \emph{provably converges to the optimal one}. The algorithm is sequential in nature, adapting its choice of policies (experiments) informed by past measurements. In addition to our theoretical analysis, we showcase our framework on applications in ecological surveillance and pharmacology.  ( 2 min )

In recent years, there have been significant advances in the use of deep learning methods in inverse problems such as denoising, compressive sensing, inpainting, and super-resolution. While this line of works has predominantly been driven by practical algorithms and experiments, it has also given rise to a variety of intriguing theoretical problems. In this paper, we survey some of the prominent theoretical developments in this line of works, focusing in particular on generative priors, untrained neural network priors, and unfolding algorithms. In addition to summarizing existing results in these topics, we highlight several ongoing challenges and open problems.  ( 2 min )

In this paper, we present a novel insider attack called Matryoshka, which employs an irrelevant scheduled-to-publish DNN model as a carrier model for covert transmission of multiple secret models which memorize the functionality of private ML data stored in local data centers. Instead of treating the parameters of the carrier model as bit strings and applying conventional steganography, we devise a novel parameter sharing approach which exploits the learning capacity of the carrier model for information hiding. Matryoshka simultaneously achieves: (i) High Capacity -- With almost no utility loss of the carrier model, Matryoshka can hide a 26x larger secret model or 8 secret models of diverse architectures spanning different application domains in the carrier model, neither of which can be done with existing steganography techniques; (ii) Decoding Efficiency -- once downloading the published carrier model, an outside colluder can exclusively decode the hidden models from the carrier model with only several integer secrets and the knowledge of the hidden model architecture; (iii) Effectiveness -- Moreover, almost all the recovered models have similar performance as if it were trained independently on the private data; (iv) Robustness -- Information redundancy is naturally implemented to achieve resilience against common post-processing techniques on the carrier before its publishing; (v) Covertness -- A model inspector with different levels of prior knowledge could hardly differentiate a carrier model from a normal model.  ( 3 min )

This paper studies the problem of forecasting general stochastic processes using an extension of the Neural Jump ODE (NJ-ODE) framework. While NJ-ODE was the first framework to establish convergence guarantees for the prediction of irregularly observed time-series, these results were limited to data stemming from It\^o-diffusions with complete observations, in particular Markov processes where all coordinates are observed simultaneously. In this work, we generalise these results to generic, possibly non-Markovian or discontinuous, stochastic processes with incomplete observations, by utilising the reconstruction properties of the signature transform. These theoretical results are supported by empirical studies, where it is shown that the path-dependent NJ-ODE outperforms the original NJ-ODE framework in the case of non-Markovian data.  ( 2 min )

Kernel ridge regression (KRR) has recently attracted renewed interest due to its potential for explaining the transient effects, such as double descent, that emerge during neural network training. In this work, we study how the alignment between the target function and the kernel affects the performance of the KRR. We focus on the truncated KRR (TKRR) which utilizes an additional parameter that controls the spectral truncation of the kernel matrix. We show that for polynomial alignment, there is an \emph{over-aligned} regime, in which TKRR can achieve a faster rate than what is achievable by full KRR. The rate of TKRR can improve all the way to the parametric rate, while that of full KRR is capped at a sub-optimal value. This shows that target alignemnt can be better leveraged by utilizing spectral truncation in kernel methods. We also consider the bandlimited alignment setting and show that the regularization surface of TKRR can exhibit transient effects including multiple descent and non-monotonic behavior. Our results show that there is a strong and quantifable relation between the shape of the \emph{alignment spectrum} and the generalization performance of kernel methods, both in terms of rates and in finite samples.  ( 2 min )

We introduce a novel, practically relevant variation of the anomaly detection problem in multi-variate time series: intrinsic anomaly detection. It appears in diverse practical scenarios ranging from DevOps to IoT, where we want to recognize failures of a system that operates under the influence of a surrounding environment. Intrinsic anomalies are changes in the functional dependency structure between time series that represent an environment and time series that represent the internal state of a system that is placed in said environment. We formalize this problem, provide under-studied public and new purpose-built data sets for it, and present methods that handle intrinsic anomaly detection. These address the short-coming of existing anomaly detection methods that cannot differentiate between expected changes in the system's state and unexpected ones, i.e., changes in the system that deviate from the environment's influence. Our most promising approach is fully unsupervised and combines adversarial learning and time series representation learning, thereby addressing problems such as label sparsity and subjectivity, while allowing to navigate and improve notoriously problematic anomaly detection data sets.  ( 2 min )

By filling in missing values in datasets, imputation allows these datasets to be used with algorithms that cannot handle missing values by themselves. However, missing values may in principle contribute useful information that is lost through imputation. The missing-indicator approach can be used in combination with imputation to instead represent this information as a part of the dataset. There are several theoretical considerations why missing-indicators may or may not be beneficial, but there has not been any large-scale practical experiment on real-life datasets to test this question for machine learning predictions. We perform this experiment for three imputation strategies and a range of different classification algorithms, on the basis of twenty real-life datasets. We find that on these datasets, missing-indicators generally increase classification performance. In addition, we find no evidence for most algorithms that nearest neighbour and iterative imputation lead to better performance than simple mean/mode imputation. Therefore, we recommend the use of missing-indicators with mean/mode imputation as a safe default, with the caveat that for decision trees, pruning is necessary to prevent overfitting. In a follow-up experiment, we determine attribute-specific missingness thresholds for each classifier above which missing-indicators are more likely than not to increase classification performance, and observe that these thresholds are much lower for categorical than for numerical attributes. Finally, we argue that mean imputation of numerical attributes may preserve some of the information from missing values, and we show that in the absence of missing-indicators, it can similarly be useful to apply mean imputation to one-hot encoded categorical attributes instead of mode imputation.  ( 3 min )

I like to go backpacking (multi-day hikes) and I want to build a model to predict how much I will enjoy the trails on my watchlist. I understand it is silly to predict how I will subjectively experience something, but it seems fun to see what gets spat out. I just have some questions on best practice. This was the best dataset I could find. It isn't perfect. I mainly hike in Canada and I only care about backpacking trails. Whereas, this dataset is about trails in the USA and only ~800/3000 are backpacking trails. From it I can get the following features: latitude longitude length elevation gain route type waterfall (boolean) lake (boolean) river (boolean) forest (boolean) cave (boolean) backpacking (boolean) rating (according to AllTrails.com, this is what I will be predicting for my watchlist trails) Another problem with this dataset is with the 5 boolean traits (waterfall, lake, river, forest, cave). If it is unknown whether a trail qualifies for any of these traits, the trait will be set to false. Also, the rating values have been rounded to the nearest 0.5 (on a scale from 0-5). I just have to make the best of it, I couldn't find a better dataset. The plan is to personalize the model to me. I'm going to add my completed trails to the dataset and give each a personal rating. Then I'll add a new feature, called something like "isMe" which will be 1 for my trails and 0 otherwise. Now, time for questions: Does it makes sense to use latitude and longitude when I don't hike in the area covered by the dataset? Should I cut the ~2200/3000 rows from the dataset that aren't backpacking trails since I only want to predict the rating for backpacking trails? Since the rating values have been binned, would that mean I am predicting a category or a numerical value? These are only the questions I can think to ask. Feel free to hit me with any other pointers you have to make this silly model as accurate as I can! submitted by /u/JamesonLKJ [link] [comments]  ( 86 min )

I saw a paper called EvilModel on how to hide malicious code in a neural network as we have thousands or millions of parameters that we can alter. This basic technique is based on the modification of the float32 values (but can be adapted to float16) where we modify the fraction bits or part of the fraction. Post/Tutorial on the process GitHub repo for the project EvilModel paper As I saw with my experiments, we could easily hide megabytes of code in a simple ResNet50 and get away with it. A well-trained (and generalized) network should not degrade in performance significantly. The testing of that is planned for a future post. Also, this method could be used for watermarking neural network weights which could help with copyright claims (e.g.: someone is using your open-sourced (and appropriately licensed) weights out of the box in a commercial product) submitted by /u/gabegabe6 [link] [comments]  ( 89 min )

I am planning to train stylegan2 ada with rectangular images (aspect ratio = 16:9). Is it better to use (zero) padding, resizing, or train a rectangular GAN? Thankyou verymuch! submitted by /u/antarfrica [link] [comments]  ( 84 min )

What differences in model performance, speed, memory etc. can I expect between choosing BF16 or FP16 for mixed precision training? Is BF16 faster / consumes less memory, since I have seen people say it is "more suitable for Deep Learning". Why is that the case? submitted by /u/optimized-adam [link] [comments]  ( 87 min )

Interested in AI/Machine learning research, hoping to check out their NA expo to learn more. Has anyone here ever been to one of their conventions? What were your experiences like? submitted by /u/nyxrat [link] [comments]  ( 84 min )

Pretrained GANs and CLIP embeddings have been used to created images from arbitrary caption, by backpropagating CLIP similarity of the caption and the generated image down to the generator input noise. I am thinking of something simpler, where I would take a pretrained GAN, and backpropagate through some pretrained classifier (e.g. image et) down to the input noise to the Generator to generate images of that class. Is there any reference that does that? And more generally, i want to understand why this approach works - simple backpropagating the classifier loss to the image (and not through the generator) typically result in deep dream type of weird images. Why does this not happen when using a generator? Is it simply because the output of the generator lives in the manifold of "real" images? Is there more to it? Thanks in advance submitted by /u/ml_rl_questions [link] [comments]  ( 86 min )

Hello friends, what are the key points we should pay attention to in the datasets you will prepare for GANs, do you have any suggestions? For example the distribution of the dataset should be like this, the images should be the same size, it is important to reduce all the images to this size, many things that I have not thought of at the moment? What are your recommendations? submitted by /u/metover [link] [comments]  ( 84 min )

https://github.com/OrigamiDream/gato I am building Deepmind's Gato imitation in TensorFlow. All necessary layers have been completely implemented. ​ However, I have no idea how to map out the training strategy, and I do not have enough datasets for this. The model seems impossible for end-to-end training because of its conditional and selective tokenizer and embeddings, and differentiable programming. ​ If you are interested in this project, add a star and notification to this repository for further updates. And someone who want to contribute to this project, please create a relevant issue or pull request. ​ Thank you. submitted by /u/AvisStudio [link] [comments]  ( 85 min )

Coming from a math/stats background the point of much of the machine learning literature can take time to understand fully, in particular I have a couple of quick (interconnected) questions regarding the essence of Diffusion models that I hope somebody may answer (of the many blog posts I have read I can't seem to find a clear answer). As a reference let me take the seminal paper of Ho et al. https://arxiv.org/abs/2006.11239 When fixing the coefficients $\beta_1, \dots, \beta_T$ that govern the forward diffusion process (treating them as hyperparameters) can't we, at least in simple cases, already recover the reverse diffusion process in closed form? If yes why do we even need to find the reverse diffusion process through an optimization procedure when we already have it in closed form? I have read that diffusion models should perform a dimensionality reduction on the data but, even understanding the mathematics, I can't understand how the dimensionality reduction is being achieved by learning the reverse process. What is the usefulness behind the whole procedure? If the forward process converges to an isotropic Gaussian (it destroys all the structure in the data) how can we hope to learn anything significant from it if it becomes simply a bunch of noise. (I suspect that the answer to this question is that we always stop the forward process before it becomes its limit) Thanks to anyone that can clear up these doubts of mine. submitted by /u/Mon0o0 [link] [comments]  ( 85 min )

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Recent got more added, hmu if you need one submitted by /u/Chemical-Exchange466 [link] [comments]  ( 83 min )

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What is the best approach to creating a video game level (for simplicity sake, just a list of positions/vectors) based on a database of already existing levels, and a set of constraints? My biggest problem is creating an AI that has no input layer, and also a variable length output. If you have any ideas, please let me know (: submitted by /u/iLoveNintend0 [link] [comments]  ( 83 min )

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​ Just a basic tutorial on using starting video and a demo of the warp/flow Working on upscaling some videos soon too that will use both warp flow and 3d animation that are looking cool so far. ​ https://www.youtube.com/watch?v=VN6dgVjzOq0 https://preview.redd.it/eul1u8v33j891.jpg?width=1920&format=pjpg&auto=webp&s=0810a191105c52bfa0d04923c9e1ba0b366940a8 submitted by /u/prfitofthesngularity [link] [comments]  ( 83 min )

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nebullvm is an open-source library that takes an AI model as input and outputs an optimized version that runs much faster on your hardware, usually achieving 2 to 5 times faster inference without losing accuracy (benchmarks below for Option A), or even more if you specify that you are willing to sacrifice some accuracy for a lighter model with even lower latency, using compression techniques (Option B, leveraging multiple quantization methods [1], soon also pruning [2] and more) https://github.com/nebuly-ai/nebullvm nebullvm now supports also PyTorch and TensorFlow backends that, together with the already supported deep learning compilers (including ONNX runtime [3], TensorRT [4], OpenVINO [5], Apache TVM [6]), will optimize how your model is mapped to your hardware. Together these techniques will allow nebullvm to explore more paths and find the best way to make the most of your hardware's computing capabilities, making inference as fast as it can run. You can run nebullvm in just a few lines of code, and after many requests from users, I simplified the installation of these deep learning compilers. In addition to the option of installing all compilers with a single command, it is now possible to skip the installation to pull Docker images with compilers already preinstalled. Discover more here. Many more releases are on the way. And if you have questions, ideas and product suggestions, I'm more than happy to discuss them here! And don't forget to leave a small star for all the open-source work to make DL optimization techniques more accessible :) https://preview.redd.it/h9rshzajhh891.png?width=1480&format=png&auto=webp&s=e4d213434a6b1f949751c4b423fe3bc581a1977d [1] Quantization. Techniques and Concept Map. [2] Pruning. Techniques and Concept Map. [3] ONNX Runtime [4] Nvidia TensorRT [5] Intel OpenVINO [6] Apache TVM submitted by /u/emilec___ [link] [comments]  ( 84 min )

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I have tried a few but most seem very random and unable to really make a ok story. I'm looking for a AI that could maybe be used to get a story started? Maybe AI has just not reached the point it can do this yet? submitted by /u/ryan7251 [link] [comments]  ( 83 min )

I am going to be posting a video later looking at Disco Diffusions Warp/Flow along with a basic tutorial on using init videos ,here are a couple of stills from 2 of the videos and some weekly images, all created with disco diffusion ​ https://preview.redd.it/eu3esyv9hg891.png?width=2560&format=png&auto=webp&s=36556998464bbf57694b1be9782632902856fd51 https://preview.redd.it/e82ynuv9hg891.png?width=2560&format=png&auto=webp&s=6dbbf93362a81d4ce897e61e316c8eb68abc7d95 https://preview.redd.it/b9fehwv9hg891.png?width=1920&format=png&auto=webp&s=fc70a0fa607dd4125dd47cce40b4fd820acb9640 submitted by /u/prfitofthesngularity [link] [comments]  ( 82 min )

RStudio on Amazon SageMaker is the industry’s first fully managed RStudio Workbench in cloud. You can quickly launch the familiar RStudio integrated development environment (IDE), and dial up and down the underlying compute resources without interrupting your work, making it easy to build machine learning (ML) and analytics solutions in R at scale. RStudio on […]  ( 11 min )

Online conversations are ubiquitous in modern life, spanning industries from video games to telecommunications. This has led to an exponential growth in the amount of online conversation data, which has helped in the development of state-of-the-art natural language processing (NLP) systems like chatbots and natural language generation (NLG) models. Over time, various NLP techniques for […]  ( 11 min )

Large attention-based transformer models have obtained massive gains on natural language processing (NLP). However, training these gigantic networks from scratch requires a tremendous amount of data and compute. For smaller NLP datasets, a simple yet effective strategy is to use a pre-trained transformer, usually trained in an unsupervised fashion on very large datasets, and fine-tune […]  ( 7 min )

With the growth in adoption of online applications and the rising number of internet users, digital fraud is on the rise year over year. Amazon Fraud Detector provides a fully managed service to help you better identify potentially fraudulent online activities using advanced machine learning (ML) techniques, and more than 20 years of fraud detection […]  ( 17 min )

Hello, I was searching for journals dedicated only for reinforcement learning. To my dissapointment, I found none. I expected there would be one or two as there are some journals that focus on neural newtorks. May I ask for some recommendations on journals for RL? I want to read about the state of the art and get some ideas for my research. I plan to publish my research at the end of the year. It is a study on state representations and models for optimizing a n-step process. So far I have found that a similar approach has been published in the IEEE. Would you be kind enough to recommend me some journals for RL? Is there any ranking that shows the difficulty of publishing in each of the journals? I am new to publishing. Thanks in advance. submitted by /u/ElvishChampion [link] [comments]  ( 83 min )

Can anyone point me to a source that talks about table sizes reasonable for Q-table learning? I see comments from the experience of people implementing it but I want to cite an academic source that talks about it. I used a Q-table in my work and the size is reasonable but I need to cite a source to support my argument. And all the papers I see only talk about curse of dimensionality and move on to deep neural nets discussion. submitted by /u/Simple-Soil-230 [link] [comments]  ( 85 min )

The game state of the inverted pendulum problem consists of four variables: cart pos, cart velocity, pole angle and pole velocity. To determine the costs of the current state, the variables have to be aggregated into a single evaluation function. The problem is, that it's possible to weight each feature differently. So the question is, if the cart's position is more important than the pole's angle? submitted by /u/ManuelRodriguez331 [link] [comments]  ( 85 min )

Hi, I wonder how can we assume y value of gaussian distribution according to action(x) as probability. I understand that the y value of pdf is not probability, but interval integration means probability. someone can explain about this? Thanks import torch from torch.distributions import Normal mean, std = 0, 1 dist = Normal(mean, std) sample = torch.tensor(0) logprob = dist.log_prob(sample) print(logprob.exp()) ## torch(0.3989) import math def normpdf(x, mean, sd): #https://stackoverflow.com/questions/12412895/how-to-calculate-probability-in-a-normal-distribution-given-mean-standard-devi var = float(sd)**2 denom = (2*math.pi*var)**.5 num = math.exp(-(float(x)-float(mean))**2/(2*var)) return num/denom print(normpdf(sample,mean,std)) ## 0.3989 submitted by /u/Spiritual_Fig3632 [link] [comments]  ( 83 min )

Silicon Valley magic met Wednesday with 175 years of industrial technology leadership as Siemens CEO Roland Busch and NVIDIA Founder and CEO Jensen Huang shared their vision for an “industrial metaverse” at the launch of the Siemens Xcelerator business platform in Munich. “When we combine the real and digital worlds we can achieve new levels Read article > The post The Metaverse Goes Industrial: Siemens, NVIDIA Extend Partnership to Bring Digital Twins Within Easy Reach appeared first on NVIDIA Blog.  ( 8 min )

NVIDIA and its partners continued to provide the best overall AI training performance and the most submissions across all benchmarks with 90% of all entries coming from the ecosystem, according to MLPerf benchmarks released today. The NVIDIA AI platform covered all eight benchmarks in the MLPerf Training 2.0 round, highlighting its leading versatility. No other Read article > The post NVIDIA, Partners Show Leading AI Performance and Versatility in MLPerf appeared first on NVIDIA Blog.  ( 7 min )

The June NVIDIA Studio Driver is available for download today, optimizing the latest creative app updates, all with the stability and reliability that users count on. Creators with NVIDIA RTX GPUs will benefit from faster performance and new features within Blender version 3.2, BorisFX Sapphire release 2022.5 and Topaz Denoise AI 3.7.0. The post NVIDIA Studio Driver Elevates Creative Workflows in Blender 3.2, BorisFX Sapphire and Topaz Denoise AI appeared first on NVIDIA Blog.  ( 7 min )

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Over the past two decades, fast-evolving technology, growing customer expectations, and implementation of new business models have… Continue reading on Becoming Human: Artificial Intelligence Magazine »  ( 17 min )

Addressing and mitigating the effects of climate change requires a collective effort, bringing our strengths to bear across industry, government, academia, and civil society. The post Introducing the Microsoft Climate Research Initiative appeared first on Microsoft Research.  ( 10 min )

Have you ever browsed through your favorite online ecommerce site and, as you were checking out, ended up with a 504 error after a delay? Or perhaps you were browsing your favorite sports site, and as you attempt to load another page, it takes a while to load back with a timeout error? These situations… Read More »Definitive Guide: An Insight Look At PHP Workers The post Definitive Guide: An Insight Look At PHP Workers appeared first on Data Science Central.  ( 20 min )

State space models have shown to be effective at modeling long range dependencies, specially on sequence classification tasks. In this work we focus on autoregressive sequence modeling over English books, Github source code and ArXiv mathematics articles. Based on recent developments around the effectiveness of gated activation functions, we propose a new layer named Gated State Space (GSS) and show that it trains significantly faster than the diagonal version of S4 (i.e. DSS) on TPUs, is fairly competitive with several well-tuned Transformer-based baselines and exhibits zero-shot generalization to longer inputs while being straightforward to implement. Finally, we show that leveraging self-attention to model local dependencies improves the performance of GSS even further.

In this work, we present an empirical study of DCGANs, including hyperparameter heuristics and image quality assessment, as a way to address the scarcity of datasets to investigate fetal head ultrasound. We present experiments to show the impact of different image resolutions, epochs, dataset size input, and learning rates for quality image assessment on four metrics: mutual information (MI), Fr\'echet inception distance (FID), peak-signal-to-noise ratio (PSNR), and local binary pattern vector (LBPv). The results show that FID and LBPv have stronger relationship with clinical image quality scores. The resources to reproduce this work are available at \url{https://github.com/budai4medtech/miua2022}.

Yoga is a globally acclaimed and widely recommended practice for a healthy living. Maintaining correct posture while performing a Yogasana is of utmost importance. In this work, we employ transfer learning from Human Pose Estimation models for extracting 136 key-points spread all over the body to train a Random Forest classifier which is used for estimation of the Yogasanas. The results are evaluated on an in-house collected extensive yoga video database of 51 subjects recorded from 4 different camera angles. We propose a 3 step scheme for evaluating the generalizability of a Yoga classifier by testing it on 1) unseen frames, 2) unseen subjects, and 3) unseen camera angles. We argue that for most of the applications, validation accuracies on unseen subjects and unseen camera angles would be most important. We empirically analyze over three public datasets, the advantage of transfer learning and the possibilities of target leakage. We further demonstrate that the classification accuracies critically depend on the cross validation method employed and can often be misleading. To promote further research, we have made key-points dataset and code publicly available.

The worldwide increase of antimicrobial resistance (AMR) is a serious threat to human health. To avert the spread of AMR, fast reliable diagnostics tools that facilitate optimal antibiotic stewardship are an unmet need. In this regard, Raman spectroscopy promises rapid label- and culture-free identification and antimicrobial susceptibility testing (AST) in a single step. However, even though many Raman-based bacteria-identification and AST studies have demonstrated impressive results, some shortcomings must be addressed. To bridge the gap between proof-of-concept studies and clinical application, we have developed machine learning techniques in combination with a novel data-augmentation algorithm, for fast identification of minimally prepared bacteria phenotypes and the distinctions of methicillin-resistant (MR) from methicillin-susceptible (MS) bacteria. For this we have implemented a spectral transformer model for hyper-spectral Raman images of bacteria. We show that our model outperforms the standard convolutional neural network models on a multitude of classification problems, both in terms of accuracy and in terms of training time. We attain more than 96$\%$ classification accuracy on a dataset consisting of 15 different classes and 95.6$\%$ classification accuracy for six MR-MS bacteria species. More importantly, our results are obtained using only fast and easy-to-produce training and test data

Many areas of deep learning benefit from using increasingly larger neural networks trained on public data, as is the case for pre-trained models for NLP and computer vision. Training such models requires a lot of computational resources (e.g., HPC clusters) that are not available to small research groups and independent researchers. One way to address it is for several smaller groups to pool their computational resources together and train a model that benefits all participants. Unfortunately, in this case, any participant can jeopardize the entire training run by sending incorrect updates, deliberately or by mistake. Training in presence of such peers requires specialized distributed training algorithms with Byzantine tolerance. These algorithms often sacrifice efficiency by introducing redundant communication or passing all updates through a trusted server, making it infeasible to apply them to large-scale deep learning, where models can have billions of parameters. In this work, we propose a novel protocol for secure (Byzantine-tolerant) decentralized training that emphasizes communication efficiency.

Over-smoothing is a challenging problem, which degrades the performance of deep graph convolutional networks (GCNs). However, existing studies for alleviating the over-smoothing problem lack either generality or effectiveness. In this paper, we analyze the underlying issues behind the over-smoothing problem, i.e., feature-diversity degeneration, gradient vanishing, and model weights over-decaying. Inspired by this, we propose a simple yet effective plug-and-play module, SkipNode, to alleviate over-smoothing. Specifically, for each middle layer of a GCN model, SkipNode randomly (or based on node degree) selects nodes to skip the convolutional operation by directly feeding their input features to the nonlinear function. Analytically, 1) skipping the convolutional operation prevents the features from losing diversity; and 2) the "skipped" nodes enable gradients to be directly passed back, thus mitigating the gradient vanishing and model weights over-decaying issues. To demonstrate the superiority of SkipNode, we conduct extensive experiments on nine popular datasets, including both homophilic and heterophilic graphs, with different graph sizes on two typical tasks: node classification and link prediction. Specifically, 1) SkipNode has strong generalizability of being applied to various GCN-based models on different datasets and tasks; and 2) SkipNode outperforms recent state-of-the-art anti-over-smoothing plug-and-play modules, i.e., DropEdge and DropNode, in different settings. Code will be made publicly available on GitHub.

Several recent works in scientific machine learning have revived interest in the application of neural networks to partial differential equations (PDEs). A popular approach is to aggregate the residual form of the governing PDE and its boundary conditions as soft penalties into a composite objective/loss function for training neural networks, which is commonly referred to as physics-informed neural networks (PINNs). In the present study, we visualize the loss landscapes and distributions of learned parameters and explain the ways this particular formulation of the objective function may hinder or even prevent convergence when dealing with challenging target solutions. We construct a purely data-driven loss function composed of both the boundary loss and the domain loss. Using this data-driven loss function and, separately, a physics-informed loss function, we then train two neural network models with the same architecture. We show that incomparable scales between boundary and domain loss terms are the culprit behind the poor performance. Additionally, we assess the performance of both approaches on two elliptic problems with increasingly complex target solutions. Based on our analysis of their loss landscapes and learned parameter distributions, we observe that a physics-informed neural network with a composite objective function formulation produces highly non-convex loss surfaces that are difficult to optimize and are more prone to the problem of vanishing gradients.

Keyword spotting (KWS) plays an essential role in enabling speech-based user interaction on smart devices, and conventional KWS (C-KWS) approaches have concentrated on detecting user-agnostic pre-defined keywords. However, in practice, most user interactions come from target users enrolled in the device which motivates to construct personalized keyword spotting. We design two personalized KWS tasks; (1) Target user Biased KWS (TB-KWS) and (2) Target user Only KWS (TO-KWS). To solve the tasks, we propose personalized keyword spotting through multi-task learning (PK-MTL) that consists of multi-task learning and task-adaptation. First, we introduce applying multi-task learning on keyword spotting and speaker verification to leverage user information to the keyword spotting system. Next, we design task-specific scoring functions to adapt to the personalized KWS tasks thoroughly. We evaluate our framework on conventional and personalized scenarios, and the results show that PK-MTL can dramatically reduce the false alarm rate, especially in various practical scenarios.

Hundreds of defenses have been proposed to make deep neural networks robust against minimal (adversarial) input perturbations. However, only a handful of these defenses held up their claims because correctly evaluating robustness is extremely challenging: Weak attacks often fail to find adversarial examples even if they unknowingly exist, thereby making a vulnerable network look robust. In this paper, we propose a test to identify weak attacks, and thus weak defense evaluations. Our test slightly modifies a neural network to guarantee the existence of an adversarial example for every sample. Consequentially, any correct attack must succeed in breaking this modified network. For eleven out of thirteen previously-published defenses, the original evaluation of the defense fails our test, while stronger attacks that break these defenses pass it. We hope that attack unit tests - such as ours - will be a major component in future robustness evaluations and increase confidence in an empirical field that is currently riddled with skepticism.

As an alternative to classical numerical solvers for partial differential equations (PDEs) subject to boundary value constraints, there has been a surge of interest in investigating neural networks that can solve such problems efficiently. In this work, we design a general solution operator for two different time-independent PDEs using graph neural networks (GNNs) and spectral graph convolutions. We train the networks on simulated data from a finite elements solver on a variety of shapes and inhomogeneities. In contrast to previous works, we focus on the ability of the trained operator to generalize to previously unseen scenarios. Specifically, we test generalization to meshes with different shapes and superposition of solutions for a different number of inhomogeneities. We find that training on a diverse dataset with lots of variation in the finite element meshes is a key ingredient for achieving good generalization results in all cases. With this, we believe that GNNs can be used to learn solution operators that generalize over a range of properties and produce solutions much faster than a generic solver. Our dataset, which we make publicly available, can be used and extended to verify the robustness of these models under varying conditions.

Model stealing attacks present a dilemma for public machine learning APIs. To protect financial investments, companies may be forced to withhold important information about their models that could facilitate theft, including uncertainty estimates and prediction explanations. This compromise is harmful not only to users but also to external transparency. Model stealing defenses seek to resolve this dilemma by making models harder to steal while preserving utility for benign users. However, existing defenses have poor performance in practice, either requiring enormous computational overheads or severe utility trade-offs. To meet these challenges, we present a new approach to model stealing defenses called gradient redirection. At the core of our approach is a provably optimal, efficient algorithm for steering an adversary's training updates in a targeted manner. Combined with improvements to surrogate networks and a novel coordinated defense strategy, our gradient redirection defense, called GRAD${}^2$, achieves small utility trade-offs and low computational overhead, outperforming the best prior defenses. Moreover, we demonstrate how gradient redirection enables reprogramming the adversary with arbitrary behavior, which we hope will foster work on new avenues of defense.

We consider the distributed SGD problem, where a main node distributes gradient calculations among $n$ workers. By assigning tasks to all the workers and waiting only for the $k$ fastest ones, the main node can trade-off the algorithm's error with its runtime by gradually increasing $k$ as the algorithm evolves. However, this strategy, referred to as adaptive $k$-sync, neglects the cost of unused computations and of communicating models to workers that reveal a straggling behavior. We propose a cost-efficient scheme that assigns tasks only to $k$ workers, and gradually increases $k$. We introduce the use of a combinatorial multi-armed bandit model to learn which workers are the fastest while assigning gradient calculations. Assuming workers with exponentially distributed response times parameterized by different means, we give empirical and theoretical guarantees on the regret of our strategy, i.e., the extra time spent to learn the mean response times of the workers. Furthermore, we propose and analyze a strategy applicable to a large class of response time distributions. Compared to adaptive $k$-sync, our scheme achieves significantly lower errors with the same computational efforts and less downlink communication while being inferior in terms of speed.

In many real-world scenarios, data to train machine learning models become available over time. However, neural network models struggle to continually learn new concepts without forgetting what has been learnt in the past. This phenomenon is known as catastrophic forgetting and it is often difficult to prevent due to practical constraints, such as the amount of data that can be stored or the limited computation sources that can be used. Moreover, training large neural networks, such as Transformers, from scratch is very costly and requires a vast amount of training data, which might not be available in the application domain of interest. A recent trend indicates that dynamic architectures based on an expansion of the parameters can reduce catastrophic forgetting efficiently in continual learning, but this needs complex tuning to balance the growing number of parameters and barely share any information across tasks. As a result, they struggle to scale to a large number of tasks without significant overhead. In this paper, we validate in the computer vision domain a recent solution called Adaptive Distillation of Adapters (ADA), which is developed to perform continual learning using pre-trained Transformers and Adapters on text classification tasks. We empirically demonstrate on different classification tasks that this method maintains a good predictive performance without retraining the model or increasing the number of model parameters over the time. Besides it is significantly faster at inference time compared to the state-of-the-art methods.

Though learning has become a core component of modern information processing, there is now ample evidence that it can lead to biased, unsafe, and prejudiced systems. The need to impose requirements on learning is therefore paramount, especially as it reaches critical applications in social, industrial, and medical domains. However, the non-convexity of most modern statistical problems is only exacerbated by the introduction of constraints. Whereas good unconstrained solutions can often be learned using empirical risk minimization, even obtaining a model that satisfies statistical constraints can be challenging. All the more so, a good one. In this paper, we overcome this issue by learning in the empirical dual domain, where constrained statistical learning problems become unconstrained and deterministic. We analyze the generalization properties of this approach by bounding the empirical duality gap -- i.e., the difference between our approximate, tractable solution and the solution of the original (non-convex) statistical problem -- and provide a practical constrained learning algorithm. These results establish a constrained counterpart to classical learning theory, enabling the explicit use of constraints in learning. We illustrate this theory and algorithm in rate-constrained learning applications arising in fairness and adversarial robustness.

As machine learning (ML) models are increasingly being employed to make consequential decisions, there has been a growing interest in developing techniques which can provide recourse to affected individuals. Majority of these techniques provide recourse under the assumption that the affected individuals will implement the prescribed recourses \emph{exactly}. However, recourses often get implemented in a noisy and inconsistent manner due to a variety of reasons e.g., an individual who was asked to increase their salary by \$500 may get a promotion which comes with a raise of \$505. Motivated by this, we study the problem of recourse invalidation in the face of noisy human responses. More specifically, we theoretically and empirically analyze the behavior of state-of-the-art algorithms, and demonstrate that the recourses generated by these algorithms are very likely to be invalidated (i.e., result in negative outcomes) if small changes are made to them. We further propose a novel framework, EXPECTing noisy responses (\texttt{EXPECT}), which addresses the aforementioned problem by explicitly minimizing the probability of recourse invalidation in the face of noisy responses. Our framework can ensure that the resulting recourses are invalidated at most $r \%$ of the time, where $r$ is provided as input by the end user requesting recourse. By doing so, our framework provides end users with greater control in navigating the trade-offs between recourse costs and robustness to noisy responses. Experimental evaluation with multiple real world datasets demonstrates the efficacy of the proposed framework, and validates our theoretical findings.

Detecting beneficial feature interactions is essential in recommender systems, and existing approaches achieve this by examining all the possible feature interactions. However, the cost of examining all the possible higher-order feature interactions is prohibitive (exponentially growing with the order increasing). Hence existing approaches only detect limited order (e.g., combinations of up to four features) beneficial feature interactions, which may miss beneficial feature interactions with orders higher than the limitation. In this paper, we propose a hypergraph neural network based model named HIRS. HIRS is the first work that directly generates beneficial feature interactions of arbitrary orders and makes recommendation predictions accordingly. The number of generated feature interactions can be specified to be much smaller than the number of all the possible interactions and hence, our model admits a much lower running time. To achieve an effective algorithm, we exploit three properties of beneficial feature interactions, and propose deep-infomax-based methods to guide the interaction generation. Our experimental results show that HIRS outperforms state-of-the-art algorithms by up to 5% in terms of recommendation accuracy.

The recent development of novel aerial vehicles capable of physically interacting with the environment leads to new applications such as contact-based inspection. These tasks require the robotic system to exchange forces with partially-known environments, which may contain uncertainties including unknown spatially-varying friction properties and discontinuous variations of the surface geometry. Finding a control strategy that is robust against these environmental uncertainties remains an open challenge. This paper presents a learning-based adaptive control strategy for aerial sliding tasks. In particular, the gains of a standard impedance controller are adjusted in real-time by a policy based on the current control signals, proprioceptive measurements, and tactile sensing. This policy is trained in simulation with simplified actuator dynamics in a student-teacher learning setup. The real-world performance of the proposed approach is verified using a tilt-arm omnidirectional flying vehicle. The proposed controller structure combines data-driven and model-based control methods, enabling our approach to successfully transfer directly and without adaptation from simulation to the real platform. Compared to fine-tuned state of the art interaction control methods we achieve reduced tracking error and improved disturbance rejection.

Estimating 3D human poses from monocular videos is a challenging task due to depth ambiguity and self-occlusion. Most existing works attempt to solve both issues by exploiting spatial and temporal relationships. However, those works ignore the fact that it is an inverse problem where multiple feasible solutions (i.e., hypotheses) exist. To relieve this limitation, we propose a Multi-Hypothesis Transformer (MHFormer) that learns spatio-temporal representations of multiple plausible pose hypotheses. In order to effectively model multi-hypothesis dependencies and build strong relationships across hypothesis features, the task is decomposed into three stages: (i) Generate multiple initial hypothesis representations; (ii) Model self-hypothesis communication, merge multiple hypotheses into a single converged representation and then partition it into several diverged hypotheses; (iii) Learn cross-hypothesis communication and aggregate the multi-hypothesis features to synthesize the final 3D pose. Through the above processes, the final representation is enhanced and the synthesized pose is much more accurate. Extensive experiments show that MHFormer achieves state-of-the-art results on two challenging datasets: Human3.6M and MPI-INF-3DHP. Without bells and whistles, its performance surpasses the previous best result by a large margin of 3% on Human3.6M. Code and models are available at \url{https://github.com/Vegetebird/MHFormer}.

This proposes a novel ensemble deep learning-based model to accurately classify, detect and localize different defect categories for aggressive pitches and thin resists (High NA applications).In particular, we train RetinaNet models using different ResNet, VGGNet architectures as backbone and present the comparison between the accuracies of these models and their performance analysis on SEM images with different types of defect patterns such as bridge, break and line collapses. Finally, we propose a preference-based ensemble strategy to combine the output predictions from different models in order to achieve better performance on classification and detection of defects. As CDSEM images inherently contain a significant level of noise, detailed feature information is often shadowed by noise. For certain resist profiles, the challenge is also to differentiate between a microbridge, footing, break, and zones of probable breaks. Therefore, we have applied an unsupervised machine learning model to denoise the SEM images to remove the False-Positive defects and optimize the effect of stochastic noise on structured pixels for better metrology and enhanced defect inspection. We repeated the defect inspection step with the same trained model and performed a comparative analysis for "robustness" and "accuracy" metric with conventional approach for both noisy/denoised image pair. The proposed ensemble method demonstrates improvement of the average precision metric (mAP) of the most difficult defect classes. In this work we have developed a novel robust supervised deep learning training scheme to accurately classify as well as localize different defect types in SEM images with high degree of accuracy. Our proposed approach demonstrates its effectiveness both quantitatively and qualitatively.

Graph neural networks (GNNs) enable the analysis of graphs using deep learning, with promising results in capturing structured information in graphs. This paper focuses on creating a small graph to represent the original graph, so that GNNs trained on the size-reduced graph can make accurate predictions. We view the original graph as a distribution of receptive fields and aim to synthesize a small graph whose receptive fields share a similar distribution. Thus, we propose Graph Condesation via Receptive Field Distribution Matching (GCDM), which is accomplished by optimizing the synthetic graph through the use of a distribution matching loss quantified by maximum mean discrepancy (MMD). Additionally, we demonstrate that the synthetic graph generated by GCDM is highly generalizable to a variety of models in evaluation phase and that the condensing speed is significantly improved using this framework.

Distributional reinforcement learning demonstrates state-of-the-art performance in continuous and discrete control settings with the features of variance and risk, which can be used to explore. However, the exploration method employing the risk property is hard to find, although numerous exploration methods in Distributional RL employ the variance of return distribution per action. In this paper, we present risk scheduling approaches that explore risk levels and optimistic behaviors from a risk perspective. We demonstrate the performance enhancement of the DMIX algorithm using risk scheduling in a multi-agent setting with comprehensive experiments.

Pretraining molecular representations is critical in a variety of applications in drug and material discovery due to the limited number of labeled molecules, yet most of existing work focuses on pretraining on 2D molecular graphs. The power of pretraining on 3D geometric structures, however, has been less explored, owning to the difficulty of finding a sufficient proxy task to empower the pretraining to effectively extract essential features from the geometric structures. Motivated by the dynamic nature of 3D molecules, where the continuous motion of a molecule in the 3D Euclidean space forms a smooth potential energy surface, we propose a 3D coordinate denoising pretraining framework to model such an energy landscape. Leveraging a SE(3)-invariant score matching method, we propose SE(3)-DDM where the coordinate denoising proxy task is effectively boiled down to the denoising of the pairwise atomic distances in a molecule. Our comprehensive experiments confirm the effectiveness and robustness of our proposed method.

While the primary goal of the exploration phase in reward-free reinforcement learning (RF-RL) is to reduce the uncertainty in the estimated model with minimum number of trajectories, in practice, the agent often needs to abide by certain safety constraint at the same time. It remains unclear how such safe exploration requirement would affect the corresponding sample complexity to achieve the desired optimality of the obtained policy in planning. In this work, we make a first attempt to answer this question. In particular, we consider the scenario where a safe baseline policy is known beforehand, and propose a unified Safe reWard-frEe ExploraTion (SWEET) framework. We then particularize the SWEET framework to the tabular and the low-rank MDP settings, and develop algorithms coined Tabular-SWEET and Low-rank-SWEET, respectively. Both algorithms leverage the concavity and continuity of the newly introduced truncated value functions, and are guaranteed to achieve zero constraint violation during exploration with high probability. Furthermore, both algorithms can provably find a near-optimal policy subject to any constraint in the planning phase. Remarkably, the sample complexities under both algorithms match or even outperform the state of the art in their constraint-free counterparts up to some constant factors, proving that safety constraint hardly increases the sample complexity for RF-RL.

The generalization of machine learning models has a complex dependence on the data, model and learning algorithm. We study train and test performance, as well as the generalization gap given by the mean of their difference over different data set samples to understand their ``typical" behavior. We derive an expression for the gap as a function of the covariance between the model parameter distribution and the train loss, and another expression for the average test performance, showing test generalization only depends on data-averaged parameter distribution and the data-averaged loss. We show that for a large class of model parameter distributions a modified generalization gap is always non-negative. By specializing further to parameter distributions produced by stochastic gradient descent (SGD), along with a few approximations and modeling considerations, we are able to predict some aspects about how the generalization gap and model train and test performance vary as a function of SGD noise. We evaluate these predictions empirically on the Cifar10 classification task based on a ResNet architecture.

On e-commerce platforms, predicting if two products are compatible with each other is an important functionality to achieve trustworthy product recommendation and search experience for consumers. However, accurately predicting product compatibility is difficult due to the heterogeneous product data and the lack of manually curated training data. We study the problem of discovering effective labeling rules that can enable weakly-supervised product compatibility prediction. We develop AMRule, a multi-view rule discovery framework that can (1) adaptively and iteratively discover novel rulers that can complement the current weakly-supervised model to improve compatibility prediction; (2) discover interpretable rules from both structured attribute tables and unstructured product descriptions. AMRule adaptively discovers labeling rules from large-error instances via a boosting-style strategy, the high-quality rules can remedy the current model's weak spots and refine the model iteratively. For rule discovery from structured product attributes, we generate composable high-order rules from decision trees; and for rule discovery from unstructured product descriptions, we generate prompt-based rules from a pre-trained language model. Experiments on 4 real-world datasets show that AMRule outperforms the baselines by 5.98% on average and improves rule quality and rule proposal efficiency.

Standard uniform convergence results bound the generalization gap of the expected loss over a hypothesis class. The emergence of risk-sensitive learning requires generalization guarantees for functionals of the loss distribution beyond the expectation. While prior works specialize in uniform convergence of particular functionals, our work provides uniform convergence for a general class of H\"older risk functionals for which the closeness in the Cumulative Distribution Function (CDF) entails closeness in risk. We establish the first uniform convergence results for estimating the CDF of the loss distribution, yielding guarantees that hold simultaneously both over all H\"older risk functionals and over all hypotheses. Thus licensed to perform empirical risk minimization, we develop practical gradient-based methods for minimizing distortion risks (widely studied subset of H\"older risks that subsumes the spectral risks, including the mean, conditional value at risk, cumulative prospect theory risks, and others) and provide convergence guarantees. In experiments, we demonstrate the efficacy of our learning procedure, both in settings where uniform convergence results hold and in high-dimensional settings with deep networks.

Cloud-based software has many advantages. When services are divided into many independent components, they are easier to update. Also, during peak demand, it is easier to scale cloud services (just hire more CPUs). Hence, many organizations are partitioning their monolithic enterprise applications into cloud-based microservices. Recently there has been much work using machine learning to simplify this partitioning task. Despite much research, no single partitioning method can be recommended as generally useful. More specifically, those prior solutions are "brittle"; i.e. if they work well for one kind of goal in one dataset, then they can be sub-optimal if applied to many datasets and multiple goals. In order to find a generally useful partitioning method, we propose DEEPLY. This new algorithm extends the CO-GCN deep learning partition generator with (a) a novel loss function and (b) some hyper-parameter optimization. As shown by our experiments, DEEPLY generally outperforms prior work (including CO-GCN, and others) across multiple datasets and goals. To the best of our knowledge, this is the first report in SE of such stable hyper-parameter optimization. To aid reuse of this work, DEEPLY is available on-line at https://bit.ly/2WhfFlB.

Network honeypots are often used by information security teams to measure the threat landscape in order to secure their networks. With the advancement of honeypot development, today's medium-interaction honeypots provide a way for security teams and researchers to deploy these active defense tools that require little maintenance on a variety of protocols. In this work, we deploy such honeypots on five different protocols on the public Internet and study the intent and sophistication of the attacks we observe. We then use the information gained to develop a clustering approach that identifies correlations in attacker behavior to discover IPs that are highly likely to be controlled by a single operator, illustrating the advantage of using these honeypots for data collection.

We introduce the Hamiltonian Monte Carlo Particle Swarm Optimizer (HMC-PSO), an optimization algorithm that reaps the benefits of both Exponentially Averaged Momentum PSO and HMC sampling. The coupling of the position and velocity of each particle with Hamiltonian dynamics in the simulation allows for extensive freedom for exploration and exploitation of the search space. It also provides an excellent technique to explore highly non-convex functions while ensuring efficient sampling. We extend the method to approximate error gradients in closed form for Deep Neural Network (DNN) settings. We discuss possible methods of coupling and compare its performance to that of state-of-the-art optimizers on the Golomb's Ruler problem and Classification tasks.

Numerical validation is at the core of machine learning research as it allows to assess the actual impact of new methods, and to confirm the agreement between theory and practice. Yet, the rapid development of the field poses several challenges: researchers are confronted with a profusion of methods to compare, limited transparency and consensus on best practices, as well as tedious re-implementation work. As a result, validation is often very partial, which can lead to wrong conclusions that slow down the progress of research. We propose Benchopt, a collaborative framework to automate, reproduce and publish optimization benchmarks in machine learning across programming languages and hardware architectures. Benchopt simplifies benchmarking for the community by providing an off-the-shelf tool for running, sharing and extending experiments. To demonstrate its broad usability, we showcase benchmarks on three standard learning tasks: $\ell_2$-regularized logistic regression, Lasso, and ResNet18 training for image classification. These benchmarks highlight key practical findings that give a more nuanced view of the state-of-the-art for these problems, showing that for practical evaluation, the devil is in the details. We hope that Benchopt will foster collaborative work in the community hence improving the reproducibility of research findings.

Keyword spotting is the task of detecting a keyword in streaming audio. Conventional keyword spotting targets predefined keywords classification, but there is growing attention in few-shot (query-by-example) keyword spotting, e.g., N-way classification given M-shot support samples. Moreover, in real-world scenarios, there can be utterances from unexpected categories (open-set) which need to be rejected rather than classified as one of the N classes. Combining the two needs, we tackle few-shot open-set keyword spotting with a new benchmark setting, named splitGSC. We propose episode-known dummy prototypes based on metric learning to detect an open-set better and introduce a simple and powerful approach, Dummy Prototypical Networks (D-ProtoNets). Our D-ProtoNets shows clear margins compared to recent few-shot open-set recognition (FSOSR) approaches in the suggested splitGSC. We also verify our method on a standard benchmark, miniImageNet, and D-ProtoNets shows the state-of-the-art open-set detection rate in FSOSR.

Recent years have seen an explosion in social media usage, allowing people to connect with others. Since the appearance of platforms such as Facebook and Twitter, such platforms influence how we speak, think, and behave. This problem negatively undermines confidence in content because of the existence of fake news. For instance, false news was a determining factor in influencing the outcome of the U.S. presidential election and other sites. Because this information is so harmful, it is essential to make sure we have the necessary tools to detect and resist it. We applied Bidirectional Long Short-Term Memory (Bi-LSTM) to determine if the news is false or real in order to showcase this study. A number of foreign websites and newspapers were used for data collection. After creating & running the model, the work achieved 84% model accuracy and 62.0 F1-macro scores with training data.

Non-convex relaxation methods have been widely used in tensor recovery problems, and compared with convex relaxation methods, can achieve better recovery results. In this paper, a new non-convex function, Minimax Logarithmic Concave Penalty (MLCP) function, is proposed, and some of its intrinsic properties are analyzed, among which it is interesting to find that the Logarithmic function is an upper bound of the MLCP function. The proposed function is generalized to tensor cases, yielding tensor MLCP and weighted tensor $L\gamma$-norm. Consider that its explicit solution cannot be obtained when applying it directly to the tensor recovery problem. Therefore, the corresponding equivalence theorems to solve such problem are given, namely, tensor equivalent MLCP theorem and equivalent weighted tensor $L\gamma$-norm theorem. In addition, we propose two EMLCP-based models for classic tensor recovery problems, namely low-rank tensor completion (LRTC) and tensor robust principal component analysis (TRPCA), and design proximal alternate linearization minimization (PALM) algorithms to solve them individually. Furthermore, based on the Kurdyka-{\L}ojasiwicz property, it is proved that the solution sequence of the proposed algorithm has finite length and converges to the critical point globally. Finally, Extensive experiments show that proposed algorithm achieve good results, and it is confirmed that the MLCP function is indeed better than the Logarithmic function in the minimization problem, which is consistent with the analysis of theoretical properties.

This work provides test error bounds for iterative fixed point methods on linear predictors -- specifically, stochastic and batch mirror descent (MD), and stochastic temporal difference learning (TD) -- with two core contributions: (a) a single proof technique which gives high probability guarantees despite the absence of projections, regularization, or any equivalents, even when optima have large or infinite norm, for quadratically-bounded losses (e.g., providing unified treatment of squared and logistic losses); (b) locally-adapted rates which depend not on global problem structure (such as condition numbers and maximum margins), but rather on properties of low norm predictors which may suffer some small excess test error. The proof technique is an elementary and versatile coupling argument, and is demonstrated here in the following settings: stochastic MD under realizability; stochastic MD for general Markov data; batch MD for general IID data; stochastic MD on heavy-tailed data (still without projections); stochastic TD on Markov chains (all prior stochastic TD bounds are in expectation).

Automation in mining requires accurate maps of road networks on site. Because roads on open-cut mines are dynamic in nature and continuously changing, manually updating road maps is tedious and error-prone. This paper investigates the possibility of automatically deriving an accurate representation of the road network using GPS data available from haul trucks operating on site. We present an overview of approaches proposed in literature and test the performance of publicly available methods on GPS data collected from trucks operating on site. Based on shortcomings seen in all tested algorithms, a post-processing step is developed which geometrically analyses the created road map for artefacts typical of free-drive areas on mine sites and significantly improves the quality of the final road network graph.

Real-time bidding is the new paradigm of programmatic advertising. An advertiser wants to make the intelligent choice of utilizing a \textbf{Demand-Side Platform} to improve the performance of their ad campaigns. Existing approaches are struggling to provide a satisfactory solution for bidding optimization due to stochastic bidding behavior. In this paper, we proposed a multi-agent reinforcement learning architecture for RTB with functional optimization. We designed four agents bidding environment: three Lagrange-multiplier based functional optimization agents and one baseline agent (without any attribute of functional optimization) First, numerous attributes have been assigned to each agent, including biased or unbiased win probability, Lagrange multiplier, and click-through rate. In order to evaluate the proposed RTB strategy's performance, we demonstrate the results on ten sequential simulated auction campaigns. The results show that agents with functional actions and rewards had the most significant average winning rate and winning surplus, given biased and unbiased winning information respectively. The experimental evaluations show that our approach significantly improve the campaign's efficacy and profitability.

For tasks where the dynamics of multiple agents are physically coupled, e.g., in cooperative manipulation, the coordination between the individual agents becomes crucial, which requires exact knowledge of the interaction dynamics. This problem is typically addressed using centralized estimators, which can negatively impact the flexibility and robustness of the overall system. To overcome this shortcoming, we propose a novel distributed learning framework for the exemplary task of cooperative manipulation using Bayesian principles. Using only local state information each agent obtains an estimate of the object dynamics and grasp kinematics. These local estimates are combined using dynamic average consensus. Due to the strong probabilistic foundation of the method, each estimate of the object dynamics and grasp kinematics is accompanied by a measure of uncertainty, which allows to guarantee a bounded prediction error with high probability. Moreover, the Bayesian principles directly allow iterative learning with constant complexity, such that the proposed learning method can be used online in real-time applications. The effectiveness of the approach is demonstrated in a simulated cooperative manipulation task.

The estimation of time-varying quantities is a fundamental component of decision making in fields such as healthcare and finance. However, the practical utility of such estimates is limited by how accurately they quantify predictive uncertainty. In this work, we address the problem of estimating the joint predictive distribution of high-dimensional multivariate time series. We propose a versatile method, based on the transformer architecture, that estimates joint distributions using an attention-based decoder that provably learns to mimic the properties of non-parametric copulas. The resulting model has several desirable properties: it can scale to hundreds of time series, supports both forecasting and interpolation, can handle unaligned and non-uniformly sampled data, and can seamlessly adapt to missing data during training. We demonstrate these properties empirically and show that our model produces state-of-the-art predictions on multiple real-world datasets.

With the latest advances in deep learning generative models, it has not taken long to take advantage of their remarkable performance in the area of time series. Deep neural networks used to work with time series depend heavily on the breadth and consistency of the datasets used in training. These types of characteristic are not usually abundant in the real world, where they are usually limited and often with privacy constraints that must be guaranteed. Therefore, an effective way is to increase the number of data using \gls{da} techniques, either by adding noise or permutations and by generating new synthetic data. It is systematically review the current state-of-the-art in the area to provide an overview of all available algorithms and proposes a taxonomy of the most relevant researches. The efficiency of the different variants will be evaluated; as a vital part of the process, the different metrics to evaluate the performance and the main problems concerning each model will be analysed. The ultimate goal of this study is to provide a summary of the evolution and performance of areas that produce better results to guide future researchers in this field.

Interest in understanding and factorizing learned embedding spaces is growing. For instance, recent concept-based explanation techniques analyze a machine learning model in terms of interpretable latent components. Such components have to be discovered in the model's embedding space, e.g., through independent component analysis (ICA) or modern disentanglement learning techniques. While these unsupervised approaches offer a sound formal framework, they either require access to a data generating function or impose rigid assumptions on the data distribution, such as independence of components, that are often violated in practice. In this work, we link conceptual explainability for vision models with disentanglement learning and ICA. This enables us to provide first theoretical results on how components can be identified without requiring any distributional assumptions. From these insights, we derive the disjoint attributions (DA) concept discovery method that is applicable to a broader class of problems than current approaches but yet possesses a formal identifiability guarantee. In an extensive comparison against component analysis and over 300 state-of-the-art disentanglement models, DA stably maintains superior performance, even under varying distributions and correlation strengths.

This work introduces the RevSilo, the first reversible module for bidirectional multi-scale feature fusion. Like other reversible methods, RevSilo eliminates the need to store hidden activations by recomputing them. Existing reversible methods, however, do not apply to multi-scale feature fusion and are therefore not applicable to a large class of networks. Bidirectional multi-scale feature fusion promotes local and global coherence and has become a de facto design principle for networks targeting spatially sensitive tasks e.g. HRNet and EfficientDet. When paired with high-resolution inputs, these networks achieve state-of-the-art results across various computer vision tasks, but training them requires substantial accelerator memory for saving large, multi-resolution activations. These memory requirements cap network size and limit progress. Using reversible recomputation, the RevSilo alleviates memory issues while still operating across resolution scales. Stacking RevSilos, we create RevBiFPN, a fully reversible bidirectional feature pyramid network. For classification, RevBiFPN is competitive with networks such as EfficientNet while using up to 19.8x lesser training memory. When fine-tuned on COCO, RevBiFPN provides up to a 2.5% boost in AP over HRNet using fewer MACs and a 2.4x reduction in training-time memory.

Test-time augmentation -- the aggregation of predictions across transformed examples of test inputs -- is an established technique to improve the performance of image classification models. Importantly, TTA can be used to improve model performance post-hoc, without additional training. Although test-time augmentation (TTA) can be applied to any data modality, it has seen limited adoption in NLP due in part to the difficulty of identifying label-preserving transformations. In this paper, we present augmentation policies that yield significant accuracy improvements with language models. A key finding is that augmentation policy design -- for instance, the number of samples generated from a single, non-deterministic augmentation -- has a considerable impact on the benefit of TTA. Experiments across a binary classification task and dataset show that test-time augmentation can deliver consistent improvements over current state-of-the-art approaches.

In many computational problems in engineering and science, function or model differentiation is essential, but also integration is needed. An important class of computational problems include so-called integro-differential equations which include both integrals and derivatives of a function. In another example, stochastic differential equations can be written in terms of a partial differential equation of a probability density function of the stochastic variable. To learn characteristics of the stochastic variable based on the density function, specific integral transforms, namely moments, of the density function need to be calculated. Recently, the machine learning paradigm of Physics-Informed Neural Networks emerged with increasing popularity as a method to solve differential equations by leveraging automatic differentiation. In this work, we propose to augment the paradigm of Physics-Informed Neural Networks with automatic integration in order to compute complex integral transforms on trained solutions, and to solve integro-differential equations where integrals are computed on-the-fly during training. Furthermore, we showcase the techniques in various application settings, numerically simulating quantum computer-based neural networks as well as classical neural networks.

Offline reinforcement learning leverages large datasets to train policies without interactions with the environment. The learned policies may then be deployed in real-world settings where interactions are costly or dangerous. Current algorithms over-fit to the training dataset and as a consequence perform poorly when deployed to out-of-distribution generalizations of the environment. We aim to address these limitations by learning a Koopman latent representation which allows us to infer symmetries of the system's underlying dynamic. The latter is then utilized to extend the otherwise static offline dataset during training; this constitutes a novel data augmentation framework which reflects the system's dynamic and is thus to be interpreted as an exploration of the environments phase space. To obtain the symmetries we employ Koopman theory in which nonlinear dynamics are represented in terms of a linear operator acting on the space of measurement functions of the system and thus symmetries of the dynamics may be inferred directly. We provide novel theoretical results on the existence and nature of symmetries relevant for control systems such as reinforcement learning settings. Moreover, we empirically evaluate our method on several benchmark offline reinforcement learning tasks and datasets including D4RL, Metaworld and Robosuite and find that by using our framework we consistently improve the state-of-the-art of model-free Q-learning methods.

While deep neural networks (DNNs) have achieved impressive classification performance in closed-world learning scenarios, they typically fail to generalize to unseen categories in dynamic open-world environments, in which the number of concepts is unbounded. In contrast, human and animal learners have the ability to incrementally update their knowledge by recognizing and adapting to novel observations. In particular, humans characterize concepts via exclusive (unique) sets of essential features, which are used for both recognizing known classes and identifying novelty. Inspired by natural learners, we introduce a Sparse High-level-Exclusive, Low-level-Shared feature representation (SHELS) that simultaneously encourages learning exclusive sets of high-level features and essential, shared low-level features. The exclusivity of the high-level features enables the DNN to automatically detect out-of-distribution (OOD) data, while the efficient use of capacity via sparse low-level features permits accommodating new knowledge. The resulting approach uses OOD detection to perform class-incremental continual learning without known class boundaries. We show that using SHELS for novelty detection results in statistically significant improvements over state-of-the-art OOD detection approaches over a variety of benchmark datasets. Further, we demonstrate that the SHELS model mitigates catastrophic forgetting in a class-incremental learning setting,enabling a combined novelty detection and accommodation framework that supports learning in open-world settings

Graph-Convolution-based methods have been successfully applied to representation learning on homophily graphs where nodes with the same label or similar attributes tend to connect with one another. Due to the homophily assumption of Graph Convolutional Networks (GCNs) that these methods use, they are not suitable for heterophily graphs where nodes with different labels or dissimilar attributes tend to be adjacent. Several methods have attempted to address this heterophily problem, but they do not change the fundamental aggregation mechanism of GCNs because they rely on summation operators to aggregate information from neighboring nodes, which is implicitly subject to the homophily assumption. Here, we introduce a novel aggregation mechanism and develop a RAndom Walk Aggregation-based Graph Neural Network (called RAW-GNN) method. The proposed approach integrates the random walk strategy with graph neural networks. The new method utilizes breadth-first random walk search to capture homophily information and depth-first search to collect heterophily information. It replaces the conventional neighborhoods with path-based neighborhoods and introduces a new path-based aggregator based on Recurrent Neural Networks. These designs make RAW-GNN suitable for both homophily and heterophily graphs. Extensive experimental results showed that the new method achieved state-of-the-art performance on a variety of homophily and heterophily graphs.

We train an LSTM network based on a pooled dataset made of hundreds of liquid stocks aiming to forecast the next daily realized volatility for all stocks. Showing the consistent outperformance of this universal LSTM relative to other asset-specific parametric models, we uncover nonparametric evidences of a universal volatility formation mechanism across assets relating past market realizations, including daily returns and volatilities, to current volatilities. A parsimonious parametric forecasting device combining the rough fractional stochastic volatility and quadratic rough Heston models with fixed parameters results in the same level of performance as the universal LSTM, which confirms the universality of the volatility formation process from a parametric perspective.

We study the problem of average-reward Markov decision processes (AMDPs) and develop novel first-order methods with strong theoretical guarantees for both policy evaluation and optimization. Existing on-policy evaluation methods suffer from sub-optimal convergence rates as well as failure in handling insufficiently random policies, e.g., deterministic policies, for lack of exploration. To remedy these issues, we develop a novel variance-reduced temporal difference (VRTD) method with linear function approximation for randomized policies along with optimal convergence guarantees, and an exploratory variance-reduced temporal difference (EVRTD) method for insufficiently random policies with comparable convergence guarantees. We further establish linear convergence rate on the bias of policy evaluation, which is essential for improving the overall sample complexity of policy optimization. On the other hand, compared with intensive research interest in finite sample analysis of policy gradient methods for discounted MDPs, existing studies on policy gradient methods for AMDPs mostly focus on regret bounds under restrictive assumptions on the underlying Markov processes (see, e.g., Abbasi-Yadkori et al., 2019), and they often lack guarantees on the overall sample complexities. Towards this end, we develop an average-reward variant of the stochastic policy mirror descent (SPMD) (Lan, 2022). We establish the first $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity for solving AMDPs with policy gradient method under both the generative model (with unichain assumption) and Markovian noise model (with ergodic assumption). This bound can be further improved to $\widetilde{\mathcal{O}}(\epsilon^{-1})$ for solving regularized AMDPs. Our theoretical advantages are corroborated by numerical experiments.

Compared with chest X-ray (CXR) imaging, which is a single image projected from the front of the patient, chest digital tomosynthesis (CDTS) imaging can be more advantageous for lung lesion detection because it acquires multiple images projected from multiple angles of the patient. Various clinical comparative analysis and verification studies have been reported to demonstrate this, but there were no artificial intelligence (AI)-based comparative analysis studies. Existing AI-based computer-aided detection (CAD) systems for lung lesion diagnosis have been developed mainly based on CXR images; however, CAD-based on CDTS, which uses multi-angle images of patients in various directions, has not been proposed and verified for its usefulness compared to CXR-based counterparts. This study develops/tests a CDTS-based AI CAD system to detect lung lesions to demonstrate performance improvements compared to CXR-based AI CAD. We used multiple projection images as input for the CDTS-based AI model and a single-projection image as input for the CXR-based AI model to fairly compare and evaluate the performance between models. The proposed CDTS-based AI CAD system yielded sensitivities of 0.782 and 0.785 and accuracies of 0.895 and 0.837 for the performance of detecting tuberculosis and pneumonia, respectively, against normal subjects. These results show higher performance than sensitivities of 0.728 and 0.698 and accuracies of 0.874 and 0.826 for detecting tuberculosis and pneumonia through the CXR-based AI CAD, which only uses a single projection image in the frontal direction. We found that CDTS-based AI CAD improved the sensitivity of tuberculosis and pneumonia by 5.4% and 8.7% respectively, compared to CXR-based AI CAD without loss of accuracy. Therefore, we comparatively prove that CDTS-based AI CAD technology can improve performance more than CXR, enhancing the clinical applicability of CDTS.

Misdiagnosis rates are one of the leading causes of medical errors in hospitals, affecting over 12 million adults across the US. To address the high rate of misdiagnosis, this study utilizes 4 NLP-based algorithms to determine the appropriate health condition based on an unstructured transcription report. From the Logistic Regression, Random Forest, LSTM, and CNNLSTM models, the CNN-LSTM model performed the best with an accuracy of 97.89%. We packaged this model into a authenticated web platform for accessible assistance to clinicians. Overall, by standardizing health care diagnosis and structuring transcription reports, our NLP platform drastically improves the clinical efficiency and accuracy of hospitals worldwide.

Out-of-distribution (OOD) detection is indispensable for machine learning models deployed in the open world. Recently, the use of an auxiliary outlier dataset during training (also known as outlier exposure) has shown promising performance. As the sample space for potential OOD data can be prohibitively large, sampling informative outliers is essential. In this work, we propose a novel posterior sampling-based outlier mining framework, POEM, which facilitates efficient use of outlier data and promotes learning a compact decision boundary between ID and OOD data for improved detection. We show that POEM establishes state-of-the-art performance on common benchmarks. Compared to the current best method that uses a greedy sampling strategy, POEM improves the relative performance by 42.0% and 24.2% (FPR95) on CIFAR-10 and CIFAR-100, respectively. We further provide theoretical insights on the effectiveness of POEM for OOD detection.

The recent emergence of reinforcement learning has created a demand for robust statistical inference methods for the parameter estimates computed using these algorithms. Existing methods for statistical inference in online learning are restricted to settings involving independently sampled observations, while existing statistical inference methods in reinforcement learning (RL) are limited to the batch setting. The online bootstrap is a flexible and efficient approach for statistical inference in linear stochastic approximation algorithms, but its efficacy in settings involving Markov noise, such as RL, has yet to be explored. In this paper, we study the use of the online bootstrap method for statistical inference in RL. In particular, we focus on the temporal difference (TD) learning and Gradient TD (GTD) learning algorithms, which are themselves special instances of linear stochastic approximation under Markov noise. The method is shown to be distributionally consistent for statistical inference in policy evaluation, and numerical experiments are included to demonstrate the effectiveness of this algorithm at statistical inference tasks across a range of real RL environments.

Robustness is a fundamental pillar of Machine Learning (ML) classifiers, substantially determining their reliability. Methods for assessing classifier robustness are therefore essential. In this work, we address the challenge of evaluating corruption robustness in a way that allows comparability and interpretability on a given dataset. We propose a test data augmentation method that uses a robustness distance $\epsilon$ derived from the datasets minimal class separation distance. The resulting MSCR (mean statistical corruption robustness) metric allows a dataset-specific comparison of different classifiers with respect to their corruption robustness. The MSCR value is interpretable, as it represents the classifiers avoidable loss of accuracy due to statistical corruptions. On 2D and image data, we show that the metric reflects different levels of classifier robustness. Furthermore, we observe unexpected optima in classifiers robust accuracy through training and testing classifiers with different levels of noise. While researchers have frequently reported on a significant tradeoff on accuracy when training robust models, we strengthen the view that a tradeoff between accuracy and corruption robustness is not inherent. Our results indicate that robustness training through simple data augmentation can already slightly improve accuracy.

Quantum neural networks are promising for a wide range of applications in the Noisy Intermediate-Scale Quantum era. As such, there is an increasing demand for automatic quantum neural architecture search. We tackle this challenge by designing a quantum circuits metric for Bayesian optimization with Gaussian process. To this goal, we propose a new quantum gates distance that characterizes the gates' action over every quantum state and provide a theoretical perspective on its geometrical properties. Our approach significantly outperforms the benchmark on three empirical quantum machine learning problems including training a quantum generative adversarial network, solving combinatorial optimization in the MaxCut problem, and simulating quantum Fourier transform. Our method can be extended to characterize behaviors of various quantum machine learning models.

Software packages like TensorFlow and PyTorch are designed to support linear algebra operations, and their speed and usability determine their success. However, by prioritising speed, they often neglect memory requirements. As a consequence, the implementations of memory-intensive algorithms that are convenient in terms of software design can often not be run for large problems due to memory overflows. Memory-efficient solutions require complex programming approaches with significant logic outside the computational framework. This impairs the adoption and use of such algorithms. To address this, we developed an XLA compiler extension that adjusts the computational data-flow representation of an algorithm according to a user-specified memory limit. We show that k-nearest neighbour and sparse Gaussian process regression methods can be run at a much larger scale on a single device, where standard implementations would have failed. Our approach leads to better use of hardware resources. We believe that further focus on removing memory constraints at a compiler level will widen the range of machine learning methods that can be developed in the future.

Modern single-cell flow and mass cytometry technologies measure the expression of several proteins of the individual cells within a blood or tissue sample. Each profiled biological sample is thus represented by a set of hundreds of thousands of multidimensional cell feature vectors, which incurs a high computational cost to predict each biological sample's associated phenotype with machine learning models. Such a large set cardinality also limits the interpretability of machine learning models due to the difficulty in tracking how each individual cell influences the ultimate prediction. We propose using Kernel Mean Embedding to encode the cellular landscape of each profiled biological sample. Although our foremost goal is to make a more transparent model, we find that our method achieves comparable or better accuracies than the state-of-the-art gating-free methods through a simple linear classifier. As a result, our model contains few parameters but still performs similarly to deep learning models with millions of parameters. In contrast with deep learning approaches, the linearity and sub-selection step of our model makes it easy to interpret classification results. Analysis further shows that our method admits rich biological interpretability for linking cellular heterogeneity to clinical phenotype.

The definition of Linear Symmetry-Based Disentanglement (LSBD) formalizes the notion of linearly disentangled representations, but there is currently no metric to quantify LSBD. Such a metric is crucial to evaluate LSBD methods and to compare to previous understandings of disentanglement. We propose $\mathcal{D}_\mathrm{LSBD}$, a mathematically sound metric to quantify LSBD, and provide a practical implementation for $\mathrm{SO}(2)$ groups. Furthermore, from this metric we derive LSBD-VAE, a semi-supervised method to learn LSBD representations. We demonstrate the utility of our metric by showing that (1) common VAE-based disentanglement methods don't learn LSBD representations, (2) LSBD-VAE as well as other recent methods can learn LSBD representations, needing only limited supervision on transformations, and (3) various desirable properties expressed by existing disentanglement metrics are also achieved by LSBD representations.

End-to-end speech-to-speech translation (S2ST) without relying on intermediate text representations is a rapidly emerging frontier of research. Recent works have demonstrated that the performance of such direct S2ST systems is approaching that of conventional cascade S2ST when trained on comparable datasets. However, in practice, the performance of direct S2ST is bounded by the availability of paired S2ST training data. In this work, we explore multiple approaches for leveraging much more widely available unsupervised and weakly-supervised speech and text data to improve the performance of direct S2ST based on Translatotron 2. With our most effective approaches, the average translation quality of direct S2ST on 21 language pairs on the CVSS-C corpus is improved by +13.6 BLEU (or +113% relatively), as compared to the previous state-of-the-art trained without additional data. The improvements on low-resource language are even more significant (+398% relatively on average). Our comparative studies suggest future research directions for S2ST and speech representation learning.

Procedural Content Generation via Reinforcement Learning (PCGRL) foregoes the need for large human-authored data-sets and allows agents to train explicitly on functional constraints, using computable, user-defined measures of quality instead of target output. We explore the application of PCGRL to 3D domains, in which content-generation tasks naturally have greater complexity and potential pertinence to real-world applications. Here, we introduce several PCGRL tasks for the 3D domain, Minecraft (Mojang Studios, 2009). These tasks will challenge RL-based generators using affordances often found in 3D environments, such as jumping, multiple dimensional movement, and gravity. We train an agent to optimize each of these tasks to explore the capabilities of previous research in PCGRL. This agent is able to generate relatively complex and diverse levels, and generalize to random initial states and control targets. Controllability tests in the presented tasks demonstrate their utility to analyze success and failure for 3D generators.

Offline reinforcement learning (RL) provides a framework for learning decision-making from offline data and therefore constitutes a promising approach for real-world applications as automated driving. Self-driving vehicles (SDV) learn a policy, which potentially even outperforms the behavior in the sub-optimal data set. Especially in safety-critical applications as automated driving, explainability and transferability are key to success. This motivates the use of model-based offline RL approaches, which leverage planning. However, current state-of-the-art methods often neglect the influence of aleatoric uncertainty arising from the stochastic behavior of multi-agent systems. This work proposes a novel approach for Uncertainty-aware Model-Based Offline REinforcement Learning Leveraging plAnning (UMBRELLA), which solves the prediction, planning, and control problem of the SDV jointly in an interpretable learning-based fashion. A trained action-conditioned stochastic dynamics model captures distinctively different future evolutions of the traffic scene. The analysis provides empirical evidence for the effectiveness of our approach in challenging automated driving simulations and based on a real-world public dataset.

Machine Learning (ML) models now inform a wide range of human decisions, but using ``black box'' models carries risks such as relying on spurious correlations or errant data. To address this, researchers have proposed methods for supplementing models with explanations of their predictions. However, robust evaluations of these methods' usefulness in real-world contexts have remained elusive, with experiments tending to rely on simplified settings or proxy tasks. We present an experimental study extending a prior explainable ML evaluation experiment and bringing the setup closer to the deployment setting by relaxing its simplifying assumptions. Our empirical study draws dramatically different conclusions than the prior work, highlighting how seemingly trivial experimental design choices can yield misleading results. Beyond the present experiment, we believe this work holds lessons about the necessity of situating the evaluation of any ML method and choosing appropriate tasks, data, users, and metrics to match the intended deployment contexts.

Pre-trained transformer language models on large unlabeled corpus have produced state-of-the-art results in natural language processing, organic molecule design, and protein sequence generation. However, no such models have been applied to learn the composition patterns of inorganic materials. Here we train a series of seven modern transformer language models (GPT, GPT-2, GPT-Neo, GPT-J, BLMM, BART, and RoBERTa) using the expanded formulas from material deposited in the ICSD, OQMD, and Materials Projects databases. Six different datasets with/out non-charge-neutral or balanced electronegativity samples are used to benchmark the performances and uncover the generation biases of modern transformer models for the generative design of materials compositions. Our extensive experiments showed that the causal language models based materials transformers can generate chemically valid materials compositions with as high as 97.54\% to be charge neutral and 91.40\% to be electronegativity balanced, which has more than 6 times higher enrichment compared to a baseline pseudo-random sampling algorithm. These models also demonstrate high novelty and their potential in new materials discovery has been proved by their capability to recover the leave-out materials. We also find that the properties of the generated samples can be tailored by training the models with selected training sets such as high-bandgap materials. Our experiments also showed that different models each have their own preference in terms of the properties of the generated samples and their running time complexity varies a lot. We have applied our materials transformer models to discover a set of new materials as validated using DFT calculations.

This project aims to explore the process of deploying Machine learning models on Kubernetes using an open-source tool called Kubeflow [1] - an end-to-end ML Stack orchestration toolkit. We create end-to-end Machine Learning models on Kubeflow in the form of pipelines and analyze various points including the ease of setup, deployment models, performance, limitations and features of the tool. We hope that our project acts almost like a seminar/introductory report that can help vanilla cloud/Kubernetes users with zero knowledge on Kubeflow use Kubeflow to deploy ML models. From setup on different clouds to serving our trained model over the internet - we give details and metrics detailing the performance of Kubeflow.

We propose that in order to harness our understanding of neuroscience toward machine learning, we must first have powerful tools for training brain-like models of learning. Although substantial progress has been made toward understanding the dynamics of learning in the brain, neuroscience-derived models of learning have yet to demonstrate the same performance capabilities as methods in deep learning such as gradient descent. Inspired by the successes of machine learning using gradient descent, we demonstrate that models of neuromodulated synaptic plasticity from neuroscience can be trained in Spiking Neural Networks (SNNs) with a framework of learning to learn through gradient descent to address challenging online learning problems. This framework opens a new path toward developing neuroscience inspired online learning algorithms.

Most of the recent few-shot learning algorithms are based on transfer learning, where a model is pre-trained using a large amount of source data, and the pre-trained model is updated using a small amount of target data afterward. In transfer-based few-shot learning, sophisticated pre-training methods have been widely studied for universal and improved representation. However, there is little study on updating pre-trained models for few-shot learning. In this paper, we compare the two popular updating methods, fine-tuning (i.e., updating the entire network) and linear probing (i.e., updating only the linear classifier), considering the distribution shift between the source and target data. We find that fine-tuning is better than linear probing as the number of samples increases, regardless of distribution shift. Next, we investigate the effectiveness and ineffectiveness of data augmentation when pre-trained models are fine-tuned. Our fundamental analyses demonstrate that careful considerations of the details about updating pre-trained models are required for better few-shot performance.

OPF problems are formulated and solved for power system operations, especially for determining generation dispatch points in real-time. For large and complex power system networks with large numbers of variables and constraints, finding the optimal solution for real-time OPF in a timely manner requires a massive amount of computing power. This paper presents a new method to reduce the number of constraints in the original OPF problem using a graph neural network (GNN). GNN is an innovative machine learning model that utilizes features from nodes, edges, and network topology to maximize its performance. In this paper, we proposed a GNN model to predict which lines would be heavily loaded or congested with given load profiles and generation capacities. Only these critical lines will be monitored in an OPF problem, creating a reduced OPF (ROPF) problem. Significant saving in computing time is expected from the proposed ROPF model. A comprehensive analysis of predictions from the GNN model was also made. It is concluded that the application of GNN for ROPF is able to reduce computing time while retaining solution quality.

An increasing ubiquity of machine learning (ML) motivates research on algorithms to explain ML models and their predictions -- so-called eXplainable Artificial Intelligence (XAI). Despite many survey papers and discussions, the goals and capabilities of XAI algorithms are far from being well understood. We argue that this is because of a problematic reasoning scheme in XAI literature: XAI algorithms are said to complement ML models with desired properties, such as "interpretability", or "explainability". These properties are in turn assumed to contribute to a goal, like "trust" in an ML system. But most properties lack precise definitions and their relationship to such goals is far from obvious. The result is a reasoning scheme that obfuscates research results and leaves an important question unanswered: What can one expect from XAI algorithms? In this article, we clarify the goals and capabilities of XAI algorithms from a concrete perspective: that of their users. Explaining ML models is only necessary if users have questions about them. We show that users can ask diverse questions, but that only one of them can be answered by current XAI algorithms. Answering this core question can be trivial, difficult or even impossible, depending on the ML application. Based on these insights, we outline which capabilities policymakers, researchers and society can reasonably expect from XAI algorithms.

Machine learning algorithms are widely used in the area of malware detection. With the growth of sample amounts, training of classification algorithms becomes more and more expensive. In addition, training data sets may contain redundant or noisy instances. The problem to be solved is how to select representative instances from large training data sets without reducing the accuracy. This work presents a new parallel instance selection algorithm called Parallel Instance Filtering (PIF). The main idea of the algorithm is to split the data set into non-overlapping subsets of instances covering the whole data set and apply a filtering process for each subset. Each subset consists of instances that have the same nearest enemy. As a result, the PIF algorithm is fast since subsets are processed independently of each other using parallel computation. We compare the PIF algorithm with several state-of-the-art instance selection algorithms on a large data set of 500,000 malicious and benign samples. The feature set was extracted using static analysis, and it includes metadata from the portable executable file format. Our experimental results demonstrate that the proposed instance selection algorithm reduces the size of a training data set significantly with the only slightly decreased accuracy. The PIF algorithm outperforms existing instance selection methods used in the experiments in terms of the ratio between average classification accuracy and storage percentage.

This paper considers the problem of measure estimation under the barycentric coding model (BCM), in which an unknown measure is assumed to belong to the set of Wasserstein-2 barycenters of a finite set of known measures. Estimating a measure under this model is equivalent to estimating the unknown barycentric coordinates. We provide novel geometrical, statistical, and computational insights for measure estimation under the BCM, consisting of three main results. Our first main result leverages the Riemannian geometry of Wasserstein-2 space to provide a procedure for recovering the barycentric coordinates as the solution to a quadratic optimization problem assuming access to the true reference measures. The essential geometric insight is that the parameters of this quadratic problem are determined by inner products between the optimal displacement maps from the given measure to the reference measures defining the BCM. Our second main result then establishes an algorithm for solving for the coordinates in the BCM when all the measures are observed empirically via i.i.d. samples. We prove precise rates of convergence for this algorithm -- determined by the smoothness of the underlying measures and their dimensionality -- thereby guaranteeing its statistical consistency. Finally, we demonstrate the utility of the BCM and associated estimation procedures in three application areas: (i) covariance estimation for Gaussian measures; (ii) image processing; and (iii) natural language processing.

Deep learning is highly pervasive in today's data-intensive era. In particular, convolutional neural networks (CNNs) are being widely adopted in a variety of fields for superior accuracy. However, computing deep CNNs on traditional CPUs and GPUs brings several performance and energy pitfalls. Several novel approaches based on ASIC, FPGA, and resistive-memory devices have been recently demonstrated with promising results. Most of them target only the inference (testing) phase of deep learning. There have been very limited attempts to design a full-fledged deep learning accelerator capable of both training and inference. It is due to the highly compute and memory-intensive nature of the training phase. In this paper, we propose LiteCON, a novel analog photonics CNN accelerator. LiteCON uses silicon microdisk-based convolution, memristor-based memory, and dense-wavelength-division-multiplexing for energy-efficient and ultrafast deep learning. We evaluate LiteCON using a commercial CAD framework (IPKISS) on deep learning benchmark models including LeNet and VGG-Net. Compared to the state-of-the-art, LiteCON improves the CNN throughput, energy efficiency, and computational efficiency by up to 32x, 37x, and 5x respectively with trivial accuracy degradation.

Dimensionality reduction (DR) plays a vital role in the visual analysis of high-dimensional data. One main aim of DR is to reveal hidden patterns that lie on intrinsic low-dimensional manifolds. However, DR often overlooks important patterns when the manifolds are strongly distorted or hidden by certain influential data attributes. This paper presents a feature learning framework, FEALM, designed to generate an optimized set of data projections for nonlinear DR in order to capture important patterns in the hidden manifolds. These projections produce maximally different nearest-neighbor graphs so that resultant DR outcomes are significantly different. To achieve such a capability, we design an optimization algorithm as well as introduce a new graph dissimilarity measure, called neighbor-shape dissimilarity. Additionally, we develop interactive visualizations to assist comparison of obtained DR results and interpretation of each DR result. We demonstrate FEALM's effectiveness through experiments using synthetic datasets and multiple case studies on real-world datasets.

SATNet is a differentiable constraint solver with a custom backpropagation algorithm, which can be used as a layer in a deep-learning system. It is a promising proposal for bridging deep learning and logical reasoning. In fact, SATNet has been successfully applied to learn, among others, the rules of a complex logical puzzle, such as Sudoku, just from input and output pairs where inputs are given as images. In this paper, we show how to improve the learning of SATNet by exploiting symmetries in the target rules of a given but unknown logical puzzle or more generally a logical formula. We present SymSATNet, a variant of SATNet that translates the given symmetries of the target rules to a condition on the parameters of SATNet and requires that the parameters should have a particular parametric form that guarantees the condition. The requirement dramatically reduces the number of parameters to learn for the rules with enough symmetries, and makes the parameter learning of SymSATNet much easier than that of SATNet. We also describe a technique for automatically discovering symmetries of the target rules from examples. Our experiments with Sudoku and Rubik's cube show the substantial improvement of SymSATNet over the baseline SATNet.

Designing reinforcement learning (RL) agents is typically a difficult process that requires numerous design iterations. Learning can fail for a multitude of reasons, and standard RL methods provide too few tools to provide insight into the exact cause. In this paper, we show how to integrate value decomposition into a broad class of actor-critic algorithms and use it to assist in the iterative agent-design process. Value decomposition separates a reward function into distinct components and learns value estimates for each. These value estimates provide insight into an agent's learning and decision-making process and enable new training methods to mitigate common problems. As a demonstration, we introduce SAC-D, a variant of soft actor-critic (SAC) adapted for value decomposition. SAC-D maintains similar performance to SAC, while learning a larger set of value predictions. We also introduce decomposition-based tools that exploit this information, including a new reward influence metric, which measures each reward component's effect on agent decision-making. Using these tools, we provide several demonstrations of decomposition's use in identifying and addressing problems in the design of both environments and agents. Value decomposition is broadly applicable and easy to incorporate into existing algorithms and workflows, making it a powerful tool in an RL practitioner's toolbox.

Contrastive self-supervised learning (SSL) learns an embedding space that maps similar data pairs closer and dissimilar data pairs farther apart. Despite its success, one issue has been overlooked: the fairness aspect of representations learned using contrastive SSL. Without mitigation, contrastive SSL techniques can incorporate sensitive information such as gender or race and cause potentially unfair predictions on downstream tasks. In this paper, we propose a Conditional Contrastive Learning (CCL) approach to improve the fairness of contrastive SSL methods. Our approach samples positive and negative pairs from distributions conditioning on the sensitive attribute, or empirically speaking, sampling positive and negative pairs from the same gender or the same race. We show that our approach provably maximizes the conditional mutual information between the learned representations of the positive pairs, and reduces the effect of the sensitive attribute by taking it as the conditional variable. On seven fairness and vision datasets, we empirically demonstrate that the proposed approach achieves state-of-the-art downstream performances compared to unsupervised baselines and significantly improves the fairness of contrastive SSL models on multiple fairness metrics.

Emergency vehicles (EMVs) play a crucial role in responding to time-critical events such as medical emergencies and fire outbreaks in an urban area. The less time EMVs spend traveling through the traffic, the more likely it would help save people's lives and reduce property loss. To reduce the travel time of EMVs, prior work has used route optimization based on historical traffic-flow data and traffic signal pre-emption based on the optimal route. However, traffic signal pre-emption dynamically changes the traffic flow which, in turn, modifies the optimal route of an EMV. In addition, traffic signal pre-emption practices usually lead to significant disturbances in traffic flow and subsequently increase the travel time for non-EMVs. In this paper, we propose EMVLight, a decentralized reinforcement learning (RL) framework for simultaneous dynamic routing and traffic signal control. EMVLight extends Dijkstra's algorithm to efficiently update the optimal route for the EMVs in real time as it travels through the traffic network. The decentralized RL agents learn network-level cooperative traffic signal phase strategies that not only reduce EMV travel time but also reduce the average travel time of non-EMVs in the network. This benefit has been demonstrated through comprehensive experiments with synthetic and real-world maps. These experiments show that EMVLight outperforms benchmark transportation engineering techniques and existing RL-based signal control methods.

Neural networks have shown tremendous growth in recent years to solve numerous problems. Various types of neural networks have been introduced to deal with different types of problems. However, the main goal of any neural network is to transform the non-linearly separable input data into more linearly separable abstract features using a hierarchy of layers. These layers are combinations of linear and nonlinear functions. The most popular and common non-linearity layers are activation functions (AFs), such as Logistic Sigmoid, Tanh, ReLU, ELU, Swish and Mish. In this paper, a comprehensive overview and survey is presented for AFs in neural networks for deep learning. Different classes of AFs such as Logistic Sigmoid and Tanh based, ReLU based, ELU based, and Learning based are covered. Several characteristics of AFs such as output range, monotonicity, and smoothness are also pointed out. A performance comparison is also performed among 18 state-of-the-art AFs with different networks on different types of data. The insights of AFs are presented to benefit the researchers for doing further research and practitioners to select among different choices. The code used for experimental comparison is released at: \url{https://github.com/shivram1987/ActivationFunctions}.

Our prior experiments show that humans and machines seem to employ different approaches to speaker discrimination, especially in the presence of speaking style variability. The experiments examined read versus conversational speech. Listeners focused on speaker-specific idiosyncrasies while "telling speakers together", and on relative distances in a shared acoustic space when "telling speakers apart". However, automatic speaker verification (ASV) systems use the same loss function irrespective of target or non-target trials. To improve ASV performance in the presence of style variability, insights learnt from human perception are used to design a new training loss function that we refer to as "CllrCE loss". CllrCE loss uses both speaker-specific idiosyncrasies and relative acoustic distances between speakers to train the ASV system. When using the UCLA speaker variability database, in the x-vector and conditioning setups, CllrCE loss results in significant relative improvements in EER by 1-66%, and minDCF by 1-31% and 1-56%, respectively, when compared to the x-vector baseline. Using the SITW evaluation tasks, which involve different conversational speech tasks, the proposed loss combined with self-attention conditioning results in significant relative improvements in EER by 2-5% and minDCF by 6-12% over baseline. In the SITW case, performance improvements were consistent only with conditioning.

Constructing efficient descriptors that represent atomic configurations is crucial for developing a superior machine-learning potential. Widely used conventional descriptors are based on two- or three-body correlations of atomic distribution. Recently, several limitations of these many-body descriptors in classifying different configurations were revealed, which have detrimental effects on the prediction of physical properties. We proposed a new class of descriptors based on persistent homology. We focused on the two-dimensional visualization of persistent homology, that is, a persistence diagram, as a descriptor of atomic configurations in the form of an image. We demonstrated that convolutional neural network models based on this descriptor provide sufficient accuracy in predicting the mean energies per atom of amorphous graphene and amorphous carbon. Our results provide an avenue for improving machine-learning potential using descriptors that depict both topological and geometric information.

Data poisoning attacks aim at manipulating model behaviors through distorting training data. Previously, an aggregation-based certified defense, Deep Partition Aggregation (DPA), was proposed to mitigate this threat. DPA predicts through an aggregation of base classifiers trained on disjoint subsets of data, thus restricting its sensitivity to dataset distortions. In this work, we propose an improved certified defense against general poisoning attacks, namely Finite Aggregation. In contrast to DPA, which directly splits the training set into disjoint subsets, our method first splits the training set into smaller disjoint subsets and then combines duplicates of them to build larger (but not disjoint) subsets for training base classifiers. This reduces the worst-case impacts of poison samples and thus improves certified robustness bounds. In addition, we offer an alternative view of our method, bridging the designs of deterministic and stochastic aggregation-based certified defenses. Empirically, our proposed Finite Aggregation consistently improves certificates on MNIST, CIFAR-10, and GTSRB, boosting certified fractions by up to 3.05%, 3.87% and 4.77%, respectively, while keeping the same clean accuracies as DPA's, effectively establishing a new state of the art in (pointwise) certified robustness against data poisoning.

Embedded machine learning (ML) systems have now become the dominant platform for deploying ML serving tasks and are projected to become of equal importance for training ML models. With this comes the challenge of overall efficient deployment, in particular low power and high throughput implementations, under stringent memory constraints. In this context, non-volatile memory (NVM) technologies such as STT-MRAM and SOT-MRAM have significant advantages compared to conventional SRAM due to their non-volatility, higher cell density, and scalability features. While prior work has investigated several architectural implications of NVM for generic applications, in this work we present DeepNVM++, a comprehensive framework to characterize, model, and analyze NVM-based caches in GPU architectures for deep learning (DL) applications by combining technology-specific circuit-level models and the actual memory behavior of various DL workloads. DeepNVM++ relies on iso-capacity and iso-area performance and energy models for last-level caches implemented using conventional SRAM and emerging STT-MRAM and SOT-MRAM technologies. In the iso-capacity case, STT-MRAM and SOT-MRAM provide up to 3.8x and 4.7x energy-delay product (EDP) reduction and 2.4x and 2.8x area reduction compared to conventional SRAM, respectively. Under iso-area assumptions, STT-MRAM and SOT-MRAM provide up to 2.2x and 2.4x EDP reduction and accommodate 2.3x and 3.3x cache capacity when compared to SRAM, respectively. We also perform a scalability analysis and show that STT-MRAM and SOT-MRAM achieve orders of magnitude EDP reduction when compared to SRAM for large cache capacities. DeepNVM++ is demonstrated on STT-/SOT-MRAM technologies and can be used for the characterization, modeling, and analysis of any NVM technology for last-level caches in GPUs for DL applications.

Being able to recommend links between users in online social networks is important for users to connect with like-minded individuals as well as for the platforms themselves and third parties leveraging social media information to grow their business. Predictions are typically based on unsupervised or supervised learning, often leveraging simple yet effective graph topological information, such as the number of common neighbors. However, we argue that richer information about personal social structure of individuals might lead to better predictions. In this paper, we propose to leverage well-established social cognitive theories to improve link prediction performance. According to these theories, individuals arrange their social relationships along, on average, five concentric circles of decreasing intimacy. We postulate that relationships in different circles have different importance in predicting new links. In order to validate this claim, we focus on popular feature-extraction prediction algorithms (both unsupervised and supervised) and we extend them to include social-circles awareness. We validate the prediction performance of these circle-aware algorithms against several benchmarks (including their baseline versions as well as node-embedding- and GNN-based link prediction), leveraging two Twitter datasets comprising a community of video gamers and generic users. We show that social-awareness generally provides significant improvements in the prediction performance, beating also state-of-the-art solutions like node2vec and SEAL, and without increasing the computational complexity. Finally, we show that social-awareness can be used in place of using a classifier (which may be costly or impractical) for targeting a specific category of users.

Machine learning (ML) has been pervasively researched nowadays and it has been applied in many aspects of real life. Nevertheless, issues of model and data still accompany the development of ML. For instance, training of traditional ML models is limited to the access of data sets, which are generally proprietary; published ML models may soon be out of date without an update of new data and continuous training; malicious data contributors may upload wrongly labeled data that leads to undesirable training results; and the abuse of private data and data leakage also exit. With the utilization of blockchain, an emerging and swiftly developing technology, these problems can be efficiently solved. In this paper, we survey the convergence of collaborative ML and blockchain. Different ways of the combination of these two technologies are investigated and their fields of application are examined. Discussion on the limitations of current research and their future directions are also included.

This paper studies the algorithmic stability and generalizability of decentralized stochastic gradient descent (D-SGD). We prove that the consensus model learned by D-SGD is $\mathcal{O}{(m/N+1/m+\lambda^2)}$-stable in expectation in the non-convex non-smooth setting, where $N$ is the total sample size of the whole system, $m$ is the worker number, and $1-\lambda$ is the spectral gap that measures the connectivity of the communication topology. These results then deliver an $\mathcal{O}{(1/N+{({(m^{-1}\lambda^2)}^{\frac{\alpha}{2}}+ m^{-\alpha})}/{N^{1-\frac{\alpha}{2}}})}$ in-average generalization bound, which is non-vacuous even when $\lambda$ is closed to $1$, in contrast to vacuous as suggested by existing literature on the projected version of D-SGD. Our theory indicates that the generalizability of D-SGD has a positive correlation with the spectral gap, and can explain why consensus control in initial training phase can ensure better generalization. Experiments of VGG-11 and ResNet-18 on CIFAR-10, CIFAR-100 and Tiny-ImageNet justify our theory. To our best knowledge, this is the first work on the topology-aware generalization of vanilla D-SGD. Code is available at https://github.com/Raiden-Zhu/Generalization-of-DSGD.

The increasing complexity of today's software requires the contribution of thousands of developers. This complex collaboration structure makes developers more likely to introduce defect-prone changes that lead to software faults. Determining when these defect-prone changes are introduced has proven challenging, and using traditional machine learning (ML) methods to make these determinations seems to have reached a plateau. In this work, we build contribution graphs consisting of developers and source files to capture the nuanced complexity of changes required to build software. By leveraging these contribution graphs, our research shows the potential of using graph-based ML to improve Just-In-Time (JIT) defect prediction. We hypothesize that features extracted from the contribution graphs may be better predictors of defect-prone changes than intrinsic features derived from software characteristics. We corroborate our hypothesis using graph-based ML for classifying edges that represent defect-prone changes. This new framing of the JIT defect prediction problem leads to remarkably better results. We test our approach on 14 open-source projects and show that our best model can predict whether or not a code change will lead to a defect with an F1 score as high as 77.55$\%$. This represents an increase of as much as 46.72$\%$ over the state-of-the-art in JIT defect prediction. We describe limitations, open challenges, and how this method can be used for operational JIT defect prediction.

Sample-efficiency guarantees for offline reinforcement learning (RL) often rely on strong assumptions on both the function classes (e.g., Bellman-completeness) and the data coverage (e.g., all-policy concentrability). Despite the recent efforts on relaxing these assumptions, existing works are only able to relax one of the two factors, leaving the strong assumption on the other factor intact. As an important open problem, can we achieve sample-efficient offline RL with weak assumptions on both factors? In this paper we answer the question in the positive. We analyze a simple algorithm based on the primal-dual formulation of MDPs, where the dual variables (discounted occupancy) are modeled using a density-ratio function against offline data. With proper regularization, we show that the algorithm enjoys polynomial sample complexity, under only realizability and single-policy concentrability. We also provide alternative analyses based on different assumptions to shed light on the nature of primal-dual algorithms for offline RL.

Heating and cooling systems in buildings account for 31% of global energy use, much of which are regulated by Rule Based Controllers (RBCs) that neither maximise energy efficiency nor minimise emissions by interacting optimally with the grid. Control via Reinforcement Learning (RL) has been shown to significantly improve building energy efficiency, but existing solutions require pre-training in simulators that are prohibitively expensive to obtain for every building in the world. In response, we show it is possible to perform safe, zero-shot control of buildings by combining ideas from system identification and model-based RL. We call this combination PEARL (Probabilistic Emission-Abating Reinforcement Learning) and show it reduces emissions without pre-training, needing only a three hour commissioning period. In experiments across three varied building energy simulations, we show PEARL outperforms an existing RBC once, and popular RL baselines in all cases, reducing building emissions by as much as 31% whilst maintaining thermal comfort.

Statistical model checking is a class of sequential algorithms that can verify specifications of interest on an ensemble of cyber-physical systems (e.g., whether 99% of cars from a batch meet a requirement on their energy efficiency). These algorithms infer the probability that given specifications are satisfied by the systems with provable statistical guarantees by drawing sufficient numbers of independent and identically distributed samples. During the process of statistical model checking, the values of the samples (e.g., a user's car energy efficiency) may be inferred by intruders, causing privacy concerns in consumer-level applications (e.g., automobiles and medical devices). This paper addresses the privacy of statistical model checking algorithms from the point of view of differential privacy. These algorithms are sequential, drawing samples until a condition on their values is met. We show that revealing the number of the samples drawn can violate privacy. We also show that the standard exponential mechanism that randomizes the output of an algorithm to achieve differential privacy fails to do so in the context of sequential algorithms. Instead, we relax the conservative requirement in differential privacy that the sensitivity of the output of the algorithm should be bounded to any perturbation for any data set. We propose a new notion of differential privacy which we call expected differential privacy. Then, we propose a novel expected sensitivity analysis for the sequential algorithm and proposed a corresponding exponential mechanism that randomizes the termination time to achieve the expected differential privacy. We apply the proposed mechanism to statistical model checking algorithms to preserve the privacy of the samples they draw. The utility of the proposed algorithm is demonstrated in a case study.

Reward function specification, which requires considerable human effort and iteration, remains a major impediment for learning behaviors through deep reinforcement learning. In contrast, providing visual demonstrations of desired behaviors often presents an easier and more natural way to teach agents. We consider a setting where an agent is provided a fixed dataset of visual demonstrations illustrating how to perform a task, and must learn to solve the task using the provided demonstrations and unsupervised environment interactions. This setting presents a number of challenges including representation learning for visual observations, sample complexity due to high dimensional spaces, and learning instability due to the lack of a fixed reward or learning signal. Towards addressing these challenges, we develop a variational model-based adversarial imitation learning (V-MAIL) algorithm. The model-based approach provides a strong signal for representation learning, enables sample efficiency, and improves the stability of adversarial training by enabling on-policy learning. Through experiments involving several vision-based locomotion and manipulation tasks, we find that V-MAIL learns successful visuomotor policies in a sample-efficient manner, has better stability compared to prior work, and also achieves higher asymptotic performance. We further find that by transferring the learned models, V-MAIL can learn new tasks from visual demonstrations without any additional environment interactions. All results including videos can be found online at \url{https://sites.google.com/view/variational-mail}.

Fake News Detection has been a challenging problem in the field of Machine Learning. Researchers have approached it via several techniques using old Statistical Classification models and modern Deep Learning. Today, with the growing amount of data, developments in the field of NLP and ML, and an increase in the computation power at disposal, there are infinite permutations and combinations to approach this problem from a different perspective. In this paper, we try different methods to tackle Fake News, and try to build, and propose the possibilities of a Hybrid Ensemble combining the classical Machine Learning techniques with the modern Deep Learning Approaches

Model predictive control (MPC) has been used widely in power electronics due to its simple concept, fast dynamic response, and good reference tracking. However, it suffers from parametric uncertainties, since it directly relies on the mathematical model of the system to predict the optimal switching states to be used at the next sampling time. As a result, uncertain parameters lead to an ill-designed MPC. Thus, this paper offers a model-free control strategy on the basis of artificial neural networks (ANNs), for mitigating the effects of parameter mismatching while having a little negative impact on the inverter's performance. This method includes two related stages. First, MPC is used as an expert to control the studied converter in order to provide a dataset, while, in the second stage, the obtained dataset is utilized to train the proposed ANN. The case study herein is based on a four-level three-cell flying capacitor inverter. In this study, MATLAB/Simulink is used to simulate the performance of the proposed method, taking into account various operating conditions. Afterward, the simulation results are reported in comparison with the conventional MPC scheme, demonstrating the superior performance of the proposed control strategy in terms of robustness against parameters mismatch and low total harmonic distortion (THD), especially when changes occur in the system parameters, compared to the conventional MPC. Furthermore, the experimental validation of the proposed method is provided based on the Hardware-in-the-Loop (HIL) simulation using the C2000TM-microcontroller-LaunchPadXL TMS320F28379D kit, demonstrating the applicability of the ANN-based control strategy to be implemented on a DSP controller.

This technical report describes the details of our TASK1A submission of the DCASE2021 challenge. The goal of the task is to design an audio scene classification system for device-imbalanced datasets under the constraints of model complexity. This report introduces four methods to achieve the goal. First, we propose Residual Normalization, a novel feature normalization method that uses instance normalization with a shortcut path to discard unnecessary device-specific information without losing useful information for classification. Second, we design an efficient architecture, BC-ResNet-Mod, a modified version of the baseline architecture with a limited receptive field. Third, we exploit spectrogram-to-spectrogram translation from one to multiple devices to augment training data. Finally, we utilize three model compression schemes: pruning, quantization, and knowledge distillation to reduce model complexity. The proposed system achieves an average test accuracy of 76.3% in TAU Urban Acoustic Scenes 2020 Mobile, development dataset with 315k parameters, and average test accuracy of 75.3% after compression to 61.0KB of non-zero parameters.

The problem of interpreting the decisions of machine learning is a well-researched and important. We are interested in a specific type of machine learning model that deals with graph data called graph neural networks. Evaluating interpretability approaches for graph neural networks (GNN) specifically are known to be challenging due to the lack of a commonly accepted benchmark. Given a GNN model, several interpretability approaches exist to explain GNN models with diverse (sometimes conflicting) evaluation methodologies. In this paper, we propose a benchmark for evaluating the explainability approaches for GNNs called Bagel. In Bagel, we firstly propose four diverse GNN explanation evaluation regimes -- 1) faithfulness, 2) sparsity, 3) correctness. and 4) plausibility. We reconcile multiple evaluation metrics in the existing literature and cover diverse notions for a holistic evaluation. Our graph datasets range from citation networks, document graphs, to graphs from molecules and proteins. We conduct an extensive empirical study on four GNN models and nine post-hoc explanation approaches for node and graph classification tasks. We open both the benchmarks and reference implementations and make them available at https://github.com/Mandeep-Rathee/Bagel-benchmark.

Business Process Simulation (BPS) is a common approach to estimate the impact of changes to a business process on its performance measures. For example, BPS allows us to estimate what would be the cycle time of a process if we automated one of its activities. The starting point of BPS is a business process model annotated with simulation parameters (a BPS model). Several studies have proposed methods to automatically discover BPS models from event logs via process mining. However, current techniques in this space discover BPS models that only capture waiting times caused by resource contention or resource unavailability. Oftentimes, a considerable portion of the waiting time in a business process is caused by extraneous delays, e.g. a resource waits for the customer to return a phone call. This paper proposes a method that discovers extraneous delays from input data, and injects timer events into a BPS model to capture the discovered delays. An empirical evaluation involving synthetic and real-life logs shows that the approach produces BPS models that better reflect the temporal dynamics of the process, relative to BPS models that do not capture extraneous delays.

We pursue a line of research that seeks to regularize the spectral norm of the Jacobian of the input-output mapping for deep neural networks. While previous work rely on upper bounding techniques, we provide a scheme that targets the exact spectral norm. We showcase that our algorithm achieves an improved generalization performance compared to previous spectral regularization techniques while simultaneously maintaining a strong safeguard against natural and adversarial noise. Moreover, we further explore some previous reasoning concerning the strong adversarial protection that Jacobian regularization provides and show that it can be misleading.

There exist well-developed frameworks for causal modelling, but these require rather a lot of human domain expertise to define causal variables and perform interventions. In order to enable autonomous agents to learn abstract causal models through interactive experience, the existing theoretical foundations need to be extended and clarified. Existing frameworks give no guidance regarding variable choice / representation, and more importantly, give no indication as to which behaviour policies or physical transformations of state space shall count as interventions. The framework sketched in this paper describes actions as transformations of state space, for instance induced by an agent running a policy. This makes it possible to describe in a uniform way both transformations of the micro-state space and abstract models thereof, and say when the latter is veridical / grounded / natural. We then introduce (causal) variables, define a mechanism as an invariant predictor, and say when an action can be viewed as a ``surgical intervention'', thus bringing the objective of causal representation & intervention skill learning into clearer focus.

Existing deep learning based facial landmark detection methods have achieved excellent performance. These methods, however, do not explicitly embed the structural dependencies among landmark points. They hence cannot preserve the geometric relationships between landmark points or generalize well to challenging conditions or unseen data. This paper proposes a method for deep structured facial landmark detection based on combining a deep Convolutional Network with a Conditional Random Field. We demonstrate its superior performance to existing state-of-the-art techniques in facial landmark detection, especially a better generalization ability on challenging datasets that include large pose and occlusion.

The von Neumann-Morgenstern (VNM) utility theorem shows that under certain axioms of rationality, decision-making is reduced to maximizing the expectation of some utility function. We extend these axioms to increasingly structured sequential decision making settings and identify the structure of the corresponding utility functions. In particular, we show that memoryless preferences lead to a utility in the form of a per transition reward and multiplicative factor on the future return. This result motivates a generalization of Markov Decision Processes (MDPs) with this structure on the agent's returns, which we call Affine-Reward MDPs. A stronger constraint on preferences is needed to recover the commonly used cumulative sum of scalar rewards in MDPs. A yet stronger constraint simplifies the utility function for goal-seeking agents in the form of a difference in some function of states that we call potential functions. Our necessary and sufficient conditions demystify the reward hypothesis that underlies the design of rational agents in reinforcement learning by adding an axiom to the VNM rationality axioms and motivates new directions for AI research involving sequential decision making.

We consider the regret minimization problem in reinforcement learning (RL) in the episodic setting. In many real-world RL environments, the state and action spaces are continuous or very large. Existing approaches establish regret guarantees by either a low-dimensional representation of the stochastic transition model or an approximation of the $Q$-functions. However, the understanding of function approximation schemes for state-value functions largely remains missing. In this paper, we propose an online model-based RL algorithm, namely the CME-RL, that learns representations of transition distributions as embeddings in a reproducing kernel Hilbert space while carefully balancing the exploitation-exploration tradeoff. We demonstrate the efficiency of our algorithm by proving a frequentist (worst-case) regret bound that is of order $\tilde{O}\big(H\gamma_N\sqrt{N}\big)$\footnote{ $\tilde{O}(\cdot)$ hides only absolute constant and poly-logarithmic factors.}, where $H$ is the episode length, $N$ is the total number of time steps and $\gamma_N$ is an information theoretic quantity relating the effective dimension of the state-action feature space. Our method bypasses the need for estimating transition probabilities and applies to any domain on which kernels can be defined. It also brings new insights into the general theory of kernel methods for approximate inference and RL regret minimization.

In compressed sensing, the goal is to reconstruct the signal from an underdetermined system of linear measurements. Thus, prior knowledge about the signal of interest and its structure is required. Additionally, in many scenarios, the signal has an unknown orientation prior to measurements. To address such recovery problems, we propose using equivariant generative models as a prior, which encapsulate orientation information in their latent space. Thereby, we show that signals with unknown orientations can be recovered with iterative gradient descent on the latent space of these models and provide additional theoretical recovery guarantees. We construct an equivariant variational autoencoder and use the decoder as generative prior for compressed sensing. We discuss additional potential gains of the proposed approach in terms of convergence and latency.

The tremendous recent progress in analyzing the training dynamics of overparameterized neural networks has primarily focused on wide networks and therefore does not sufficiently address the role of depth in deep learning. In this work, we present the first trainability guarantee of infinitely deep but narrow neural networks. We study the infinite-depth limit of a multilayer perceptron (MLP) with a specific initialization and establish a trainability guarantee using the NTK theory. We then extend the analysis to an infinitely deep convolutional neural network (CNN) and perform brief experiments.

Multi-label aspect category detection allows a given review sentence to contain multiple aspect categories, which is shown to be more practical in sentiment analysis and attracting increasing attention. As annotating large amounts of data is time-consuming and labor-intensive, data scarcity occurs frequently in real-world scenarios, which motivates multi-label few-shot aspect category detection. However, research on this problem is still in infancy and few methods are available. In this paper, we propose a novel label-enhanced prototypical network (LPN) for multi-label few-shot aspect category detection. The highlights of LPN can be summarized as follows. First, it leverages label description as auxiliary knowledge to learn more discriminative prototypes, which can retain aspect-relevant information while eliminating the harmful effect caused by irrelevant aspects. Second, it integrates with contrastive learning, which encourages that the sentences with the same aspect label are pulled together in embedding space while simultaneously pushing apart the sentences with different aspect labels. In addition, it introduces an adaptive multi-label inference module to predict the aspect count in the sentence, which is simple yet effective. Extensive experimental results on three datasets demonstrate that our proposed model LPN can consistently achieve state-of-the-art performance.

Research shows that exposure to suicide-related news media content is associated with suicide rates, with some content characteristics likely having harmful and others potentially protective effects. Although good evidence exists for a few selected characteristics, systematic large scale investigations are missing in general, and in particular for social media data. We apply machine learning methods to classify large quantities of Twitter data according to a novel annotation scheme that distinguishes 12 categories of suicide-related tweets. We then trained a benchmark of machine learning models including a majority classifier, an approach based on word frequency (TF-IDF with a linear SVM) and two state-of-the-art deep learning models (BERT, XLNet). The two deep learning models achieved the best performance in two classification tasks: In the first task, we classified six main content categories, including personal stories about either suicidal ideation and attempts or coping, calls for action intending to spread either problem awareness or prevention-related information, reporting of suicide cases, and other tweets irrelevant to these categories. The deep learning models reached accuracy scores above 73% on average across the six categories, and F1-scores in between 0.70 and 0.85 for all but the suicidal ideation and attempts category (0.51-0.55). In the second task, separating tweets referring to actual suicide from off-topic tweets, they correctly labeled around 88% of tweets, with BERT achieving F1-scores of 0.93 and 0.74 for the two categories, respectively. These classification performances are comparable to the state-of-the-art on similar tasks. By making data labeling more efficient, this work has enabled large-scale investigations on harmful and protective associations of social media content with suicide rates and help-seeking behavior.

We propose a general formulation for continuous treatment recommendation problems in settings with clinical survival data, which we call the Deep Survival Dose Response Function (DeepSDRF). That is, we consider the problem of learning the conditional average dose response (CADR) function solely from historical data in which observed factors (confounders) affect both observed treatment and time-to-event outcomes. The estimated treatment effect from DeepSDRF enables us to develop recommender algorithms with the correction for selection bias. We compared two recommender approaches based on random search and reinforcement learning and found similar performance in terms of patient outcome. We tested the DeepSDRF and the corresponding recommender on extensive simulation studies and the eICU Research Institute (eRI) database. To the best of our knowledge, this is the first time that causal models are used to address the continuous treatment effect with observational data in a medical context.

Graph neural networks (GNNs) use graph convolutions to exploit network invariances and learn meaningful feature representations from network data. However, on large-scale graphs convolutions incur in high computational cost, leading to scalability limitations. Leveraging the graphon -- the limit object of a graph -- in this paper we consider the problem of learning a graphon neural network (WNN) -- the limit object of a GNN -- by training GNNs on graphs sampled from the graphon. Under smoothness conditions, we show that: (i) the expected distance between the learning steps on the GNN and on the WNN decreases asymptotically with the size of the graph, and (ii) when training on a sequence of growing graphs, gradient descent follows the learning direction of the WNN. Inspired by these results, we propose a novel algorithm to learn GNNs on large-scale graphs that, starting from a moderate number of nodes, successively increases the size of the graph during training. This algorithm is further benchmarked on a decentralized control problem, where it retains comparable performance to its large-scale counterpart at a reduced computational cost.

We explore the use of Optical Processing Units (OPU) to compute random Fourier features for sketching, and adapt the overall compressive clustering pipeline to this setting. We also propose some tools to help tuning a critical hyper-parameter of compressive clustering.

Autonomous underwater vehicles (AUV) perform various applications such as seafloor mapping and underwater structure health monitoring. Commonly, an inertial navigation system aided by a Doppler velocity log (DVL) is used to provide the vehicle's navigation solution. In such fusion, the DVL provides the velocity vector of the AUV, which determines the navigation solution's accuracy and helps estimate the navigation states. This paper proposes BeamsNet, an end-to-end deep learning framework to regress the estimated DVL velocity vector that improves the accuracy of the velocity vector estimate, and could replace the model-based approach. Two versions of BeamsNet, differing in their input to the network, are suggested. The first uses the current DVL beam measurements and inertial sensors data, while the other utilizes only DVL data, taking the current and past DVL measurements for the regression process. Both simulation and sea experiments were made to validate the proposed learning approach relative to the model-based approach. Sea experiments were made with the Snapir AUV in the Mediterranean Sea, collecting approximately four hours of DVL and inertial sensor data. Our results show that the proposed approach achieved an improvement of more than 60% in estimating the DVL velocity vector.

In Machine Learning, Artificial Neural Networks (ANNs) are a very powerful tool, broadly used in many applications. Often, the selected (deep) architectures include many layers, and therefore a large amount of parameters, which makes training, storage and inference expensive. This motivated a stream of research about compressing the original networks into smaller ones without excessively sacrificing performances. Among the many proposed compression approaches, one of the most popular is \emph{pruning}, whereby entire elements of the ANN (links, nodes, channels, \ldots) and the corresponding weights are deleted. Since the nature of the problem is inherently combinatorial (what elements to prune and what not), we propose a new pruning method based on Operational Research tools. We start from a natural Mixed-Integer-Programming model for the problem, and we use the Perspective Reformulation technique to strengthen its continuous relaxation. Projecting away the indicator variables from this reformulation yields a new regularization term, which we call the Structured Perspective Regularization, that leads to structured pruning of the initial architecture. We test our method on some ResNet architectures applied to CIFAR-10, CIFAR-100 and ImageNet datasets, obtaining competitive performances w.r.t.~the state of the art for structured pruning.

Recent studies have shown great promise in applying graph neural networks for multivariate time series forecasting, where the interactions of time series are described as a graph structure and the variables are represented as the graph nodes. Along this line, existing methods usually assume that the graph structure (or the adjacency matrix), which determines the aggregation manner of graph neural network, is fixed either by definition or self-learning. However, the interactions of variables can be dynamic and evolutionary in real-world scenarios. Furthermore, the interactions of time series are quite different if they are observed at different time scales. To equip the graph neural network with a flexible and practical graph structure, in this paper, we investigate how to model the evolutionary and multi-scale interactions of time series. In particular, we first provide a hierarchical graph structure cooperated with the dilated convolution to capture the scale-specific correlations among time series. Then, a series of adjacency matrices are constructed under a recurrent manner to represent the evolving correlations at each layer. Moreover, a unified neural network is provided to integrate the components above to get the final prediction. In this way, we can capture the pair-wise correlations and temporal dependency simultaneously. Finally, experiments on both single-step and multi-step forecasting tasks demonstrate the superiority of our method over the state-of-the-art approaches.

Learning disentangled representations with variational autoencoders (VAEs) is often attributed to the regularisation component of the loss. In this work, we highlight the interaction between data and the reconstruction term of the loss as the main contributor to disentanglement in VAEs. We note that standardised benchmark datasets are constructed in ways that are conducive to learning what appear to be disentangled representations. We design an intuitive adversarial dataset that exploits this mechanism to break existing state-of-the-art disentanglement frameworks. Finally, we supply a solution that enables disentanglement by modifying the reconstruction loss, affecting how VAEs perceive distances between data points.

Following the success of convolution on non-Euclidean space, the corresponding pooling approaches have also been validated on various tasks regarding graphs. However, because of the fixed compression quota and stepwise pooling design, these hierarchical pooling methods still suffer from local structure damage and suboptimal problem. In this work, inspired by structural entropy, we propose a hierarchical pooling approach, SEP, to tackle the two issues. Specifically, without assigning the layer-specific compression quota, a global optimization algorithm is designed to generate the cluster assignment matrices for pooling at once. Then, we present an illustration of the local structure damage from previous methods in the reconstruction of ring and grid synthetic graphs. In addition to SEP, we further design two classification models, SEP-G and SEP-N for graph classification and node classification, respectively. The results show that SEP outperforms state-of-the-art graph pooling methods on graph classification benchmarks and obtains superior performance on node classifications.

Predicting the dynamic behaviors of particles in suspension subject to hydrodynamic interaction (HI) and external drive can be critical for many applications. By harvesting advanced deep learning techniques, the present work introduces a new framework, hydrodynamic interaction graph neural network (HIGNN), for inferring and predicting the particles' dynamics in Stokes suspensions. It overcomes the limitations of traditional approaches in computational efficiency, accuracy, and/or transferability. In particular, by uniting the data structure represented by a graph and the neural networks with learnable parameters, the HIGNN constructs surrogate modeling for the mobility tensor of particles which is the key to predicting the dynamics of particles subject to HI and external forces. To account for the many-body nature of HI, we generalize the state-of-the-art GNN by introducing higher-order connectivity into the graph and the corresponding convolutional operation. For training the HIGNN, we only need the data for a small number of particles in the domain of interest, and hence the training cost can be maintained low. Once constructed, the HIGNN permits fast predictions of the particles' velocities and is transferable to suspensions of different numbers/concentrations of particles in the same domain and to any external forcing. It has the ability to accurately capture both the long-range HI and short-range lubrication effects. We demonstrate the accuracy, efficiency, and transferability of the proposed HIGNN framework in a variety of systems. The requirement on computing resource is minimum: most simulations only require a desktop with one GPU; the simulations for a large suspension of 100,000 particles call for up to 6 GPUs.

We propose a new approach to the optimal placement of sensors for the problem of reconstructing geophysical fields from sparse measurements. Our method consists of two stages. In the first stage, we estimate the variability of the physical field as a function of spatial coordinates by approximating its information entropy through the Conditional PixelCNN network. To calculate the entropy, a new ordering of a two-dimensional data array (spiral ordering) is proposed, which makes it possible to obtain the entropy of a physical field simultaneously for several spatial scales. In the second stage, the entropy of the physical field is used to initialize the distribution of optimal sensor locations. This distribution is further optimized with the Concrete Autoencoder architecture with the straight-through gradient estimator and adversarial loss to simultaneously minimize the number of sensors and maximize reconstruction accuracy. Our method scales linearly with data size, unlike commonly used Principal Component Analysis. We demonstrate our method on the two examples: (a) temperature and (b) salinity fields around the Barents Sea and the Svalbard group of islands. For these examples, we compute the reconstruction error of our method and a few baselines. We test our approach against two baselines (1) PCA with QR factorization and (2) climatology. We find out that the obtained optimal sensor locations have clear physical interpretation and correspond to the boundaries between sea currents.

Recently, Transformer has become a prevailing deep architecture for solving vehicle routing problems (VRPs). However, it is less effective in learning improvement models for VRP because its positional encoding (PE) method is not suitable in representing VRP solutions. This paper presents a novel Dual-Aspect Collaborative Transformer (DACT) to learn embeddings for the node and positional features separately, instead of fusing them together as done in existing ones, so as to avoid potential noises and incompatible correlations. Moreover, the positional features are embedded through a novel cyclic positional encoding (CPE) method to allow Transformer to effectively capture the circularity and symmetry of VRP solutions (i.e., cyclic sequences). We train DACT using Proximal Policy Optimization and design a curriculum learning strategy for better sample efficiency. We apply DACT to solve the traveling salesman problem (TSP) and capacitated vehicle routing problem (CVRP). Results show that our DACT outperforms existing Transformer based improvement models, and exhibits much better generalization performance across different problem sizes on synthetic and benchmark instances, respectively.

To solve tasks in complex environments, robots need to learn from experience. Deep reinforcement learning is a common approach to robot learning but requires a large amount of trial and error to learn, limiting its deployment in the physical world. As a consequence, many advances in robot learning rely on simulators. On the other hand, learning inside of simulators fails to capture the complexity of the real world, is prone to simulator inaccuracies, and the resulting behaviors do not adapt to changes in the world. The Dreamer algorithm has recently shown great promise for learning from small amounts of interaction by planning within a learned world model, outperforming pure reinforcement learning in video games. Learning a world model to predict the outcomes of potential actions enables planning in imagination, reducing the amount of trial and error needed in the real environment. However, it is unknown whether Dreamer can facilitate faster learning on physical robots. In this paper, we apply Dreamer to 4 robots to learn online and directly in the real world, without simulators. Dreamer trains a quadruped robot to roll off its back, stand up, and walk from scratch and without resets in only 1 hour. We then push the robot and find that Dreamer adapts within 10 minutes to withstand perturbations or quickly roll over and stand back up. On two different robotic arms, Dreamer learns to pick and place multiple objects directly from camera images and sparse rewards, approaching human performance. On a wheeled robot, Dreamer learns to navigate to a goal position purely from camera images, automatically resolving ambiguity about the robot orientation. Using the same hyperparameters across all experiments, we find that Dreamer is capable of online learning in the real world, establishing a strong baseline. We release our infrastructure for future applications of world models to robot learning.

Symbolic regression, i.e. predicting a function from the observation of its values, is well-known to be a challenging task. In this paper, we train Transformers to infer the function or recurrence relation underlying sequences of integers or floats, a typical task in human IQ tests which has hardly been tackled in the machine learning literature. We evaluate our integer model on a subset of OEIS sequences, and show that it outperforms built-in Mathematica functions for recurrence prediction. We also demonstrate that our float model is able to yield informative approximations of out-of-vocabulary functions and constants, e.g. $\operatorname{bessel0}(x)\approx \frac{\sin(x)+\cos(x)}{\sqrt{\pi x}}$ and $1.644934\approx \pi^2/6$. An interactive demonstration of our models is provided at https://symbolicregression.metademolab.com.

Dynamic model pruning is a recent direction that allows for the inference of a different sub-network for each input sample during deployment. However, current dynamic methods rely on learning a continuous channel gating through regularization by inducing sparsity loss. This formulation introduces complexity in balancing different losses (e.g task loss, regularization loss). In addition, regularization based methods lack transparent tradeoff hyperparameter selection to realize computational budget. Our contribution is two-fold: 1) decoupled task and pruning training. 2) Simple hyperparameter selection that enables FLOPs reduction estimation before training. Inspired by the Hebbian theory in Neuroscience: "neurons that fire together wire together", we propose to predict a mask to process k filters in a layer based on the activation of its previous layer. We pose the problem as a self-supervised binary classification problem. Each mask predictor module is trained to predict if the log-likelihood for each filter in the current layer belongs to the top-k activated filters. The value k is dynamically estimated for each input based on a novel criterion using the mass of heatmaps. We show experiments on several neural architectures, such as VGG, ResNet and MobileNet on CIFAR and ImageNet datasets. On CIFAR, we reach similar accuracy to SOTA methods with 15% and 24% higher FLOPs reduction. Similarly in ImageNet, we achieve lower drop in accuracy with up to 13% improvement in FLOPs reduction.

This paper details our winning submission to Phase 1 of the 2021 Real Robot Challenge; a challenge in which a three-fingered robot must carry a cube along specified goal trajectories. To solve Phase 1, we use a pure reinforcement learning approach which requires minimal expert knowledge of the robotic system, or of robotic grasping in general. A sparse, goal-based reward is employed in conjunction with Hindsight Experience Replay to teach the control policy to move the cube to the desired x and y coordinates of the goal. Simultaneously, a dense distance-based reward is employed to teach the policy to lift the cube to the z coordinate (the height component) of the goal. The policy is trained in simulation with domain randomisation before being transferred to the real robot for evaluation. Although performance tends to worsen after this transfer, our best policy can successfully lift the real cube along goal trajectories via an effective pinching grasp. Our approach outperforms all other submissions, including those leveraging more traditional robotic control techniques, and is the first pure learning-based method to solve this challenge.

It is an elementary fact in the scientific literature that the Lipschitz norm of the realization function of a feedforward fully-connected rectified linear unit (ReLU) artificial neural network (ANN) can, up to a multiplicative constant, be bounded from above by sums of powers of the norm of the ANN parameter vector. Roughly speaking, in this work we reveal in the case of shallow ANNs that the converse inequality is also true. More formally, we prove that the norm of the equivalence class of ANN parameter vectors with the same realization function is, up to a multiplicative constant, bounded from above by the sum of powers of the Lipschitz norm of the ANN realization function (with the exponents $ 1/2 $ and $ 1 $). Moreover, we prove that this upper bound only holds when employing the Lipschitz norm but does neither hold for H\"older norms nor for Sobolev-Slobodeckij norms. Furthermore, we prove that this upper bound only holds for sums of powers of the Lipschitz norm with the exponents $ 1/2 $ and $ 1 $ but does not hold for the Lipschitz norm alone.

This paper introduces an efficient algorithm for persistence diagram computation, given an input piecewise linear scalar field f defined on a d-dimensional simplicial complex K, with $d \leq 3$. Our method extends the seminal "PairCells" algorithm by introducing three main accelerations. First, we express this algorithm within the setting of discrete Morse theory, which considerably reduces the number of input simplices to consider. Second, we introduce a stratification approach to the problem, that we call "sandwiching". Specifically, minima-saddle persistence pairs ($D_0(f)$) and saddle-maximum persistence pairs ($D_{d-1}(f)$) are efficiently computed by respectively processing with a Union-Find the unstable sets of 1-saddles and the stable sets of (d-1)-saddles. This fast processing of the dimensions 0 and (d-1) further reduces, and drastically, the number of critical simplices to consider for the computation of $D_1(f)$, the intermediate layer of the sandwich. Third, we document several performance improvements via shared-memory parallelism. We provide an open-source implementation of our algorithm for reproducibility purposes. We also contribute a reproducible benchmark package, which exploits three-dimensional data from a public repository and compares our algorithm to a variety of publicly available implementations. Extensive experiments indicate that our algorithm improves by two orders of magnitude the time performance of the seminal "PairCells" algorithm it extends. Moreover, it also improves memory footprint and time performance over a selection of 14 competing approaches, with a substantial gain over the fastest available approaches, while producing a strictly identical output. We illustrate the utility of our contributions with an application to the fast and robust extraction of persistent 1-dimensional generators on surfaces, volume data and high-dimensional point clouds.

When used in autonomous driving, goal recognition allows the future behaviour of other vehicles to be more accurately predicted. A recent goal recognition method for autonomous vehicles, GRIT, has been shown to be fast, accurate, interpretable and verifiable. In autonomous driving, vehicles can encounter novel scenarios that were unseen during training, and the environment is partially observable due to occlusions. However, GRIT can only operate in fixed frame scenarios, with full observability. We present a novel goal recognition method named Goal Recognition with Interpretable Trees under Occlusion (OGRIT), which solves these shortcomings of GRIT. We demonstrate that OGRIT can generalise between different scenarios and handle missing data due to occlusions, while still being fast, accurate, interpretable and verifiable.

We revisit the problem of fair clustering, first introduced by Chierichetti et al., that requires each protected attribute to have approximately equal representation in every cluster; i.e., a balance property. Existing solutions to fair clustering are either not scalable or do not achieve an optimal trade-off between clustering objective and fairness. In this paper, we propose a new notion of fairness, which we call $tau$-fair fairness, that strictly generalizes the balance property and enables a fine-grained efficiency vs. fairness trade-off. Furthermore, we show that simple greedy round-robin based algorithms achieve this trade-off efficiently. Under a more general setting of multi-valued protected attributes, we rigorously analyze the theoretical properties of the our algorithms. Our experimental results suggest that the proposed solution outperforms all the state-of-the-art algorithms and works exceptionally well even for a large number of clusters.

For the identification of switched systems with a measured switching signal, this work aims to analyze the effect of switching strategies on the estimation error. The data for identification is assumed to be collected from globally asymptotically or marginally stable switched systems under switches that are arbitrary or subject to an average dwell time constraint. Then the switched system is estimated by the least-squares (LS) estimator. To capture the effect of the parameters of the switching strategies on the LS estimation error, finite-sample error bounds are developed in this work. The obtained error bounds show that the estimation error is logarithmic of the switching parameters when there are only stable modes; however, when there are unstable modes, the estimation error bound can increase linearly as the switching parameter changes. This suggests that in the presence of unstable modes, the switching strategy should be properly designed to avoid the significant increase of the estimation error.

We propose and analyze a reinforcement learning principle that approximates the Bellman equations by enforcing their validity only along an user-defined space of test functions. Focusing on applications to model-free offline RL with function approximation, we exploit this principle to derive confidence intervals for off-policy evaluation, as well as to optimize over policies within a prescribed policy class. We prove an oracle inequality on our policy optimization procedure in terms of a trade-off between the value and uncertainty of an arbitrary comparator policy. Different choices of test function spaces allow us to tackle different problems within a common framework. We characterize the loss of efficiency in moving from on-policy to off-policy data using our procedures, and establish connections to concentrability coefficients studied in past work. We examine in depth the implementation of our methods with linear function approximation, and provide theoretical guarantees with polynomial-time implementations even when Bellman closure does not hold.

Many countries have experienced at least two waves of the COVID-19 pandemic. The second wave is far more dangerous as distinct strains appear more harmful to human health, but it stems from the complacency about the first wave. This paper introduces a parsimonious yet representative stochastic epidemic model that simulates the uncertain spread of the disease regardless of the latency and recovery time distributions. We also propose a Markov decision process to seek an optimal trade-off between the usage of the healthcare system and the economic costs of an epidemic. We apply the model to COVID-19 data from New Delhi, India and simulate the epidemic spread with different policy review times. The results show that the optimal policy acts swiftly to curb the epidemic in the first wave, thus avoiding the collapse of the healthcare system and the future costs of posterior outbreaks. An analysis of the recent collapse of the healthcare system of India during the second COVID-19 wave suggests that many lives could have been preserved if swift mitigation was promoted after the first wave.

Tensor decomposition is an effective tool for learning multi-way structures and heterogeneous features from high-dimensional data, such as the multi-view images and multichannel electroencephalography (EEG) signals, are often represented by tensors. However, most of tensor decomposition methods are the linear feature extraction techniques, which are unable to reveal the nonlinear structure within high-dimensional data. To address such problem, a lot of algorithms have been proposed for simultaneously performs linear and non-linear feature extraction. A representative algorithm is the Graph Regularized Non-negative Matrix Factorization (GNMF) for image clustering. However, the normal 2-order graph can only models the pairwise similarity of objects, which cannot sufficiently exploit the complex structures of samples. Thus, we propose a novel method, named Hypergraph Regularized Non-negative Tensor Factorization (HyperNTF), which utilizes hypergraph to encode the complex connections among samples and employs the factor matrix corresponding with last mode of Canonical Polyadic (CP) decomposition as low-dimensional representation. Extensive experiments on synthetic manifolds, real-world image datasets, and EEG signals, demonstrating that HyperNTF outperforms the state-of-the-art methods in terms of dimensionality reduction, clustering, and classification.

In medicine, survival analysis studies the time duration to events of interest such as mortality. One major challenge is how to deal with multiple competing events (e.g., multiple disease diagnoses). In this work, we propose a transformer-based model that does not make the assumption for the underlying survival distribution and is capable of handling competing events, namely SurvTRACE. We account for the implicit \emph{confounders} in the observational setting in multi-events scenarios, which causes selection bias as the predicted survival probability is influenced by irrelevant factors. To sufficiently utilize the survival data to train transformers from scratch, multiple auxiliary tasks are designed for multi-task learning. The model hence learns a strong shared representation from all these tasks and in turn serves for better survival analysis. We further demonstrate how to inspect the covariate relevance and importance through interpretable attention mechanisms of SurvTRACE, which suffices to great potential in enhancing clinical trial design and new treatment development. Experiments on METABRIC, SUPPORT, and SEER data with 470k patients validate the all-around superiority of our method.

Audio DeepFakes allow the creation of high-quality, convincing utterances and therefore pose a threat due to its potential applications such as impersonation or fake news. Methods for detecting these manipulations should be characterized by good generalization and stability leading to robustness against attacks conducted with techniques that are not explicitly included in the training. In this work, we introduce Attack Agnostic Dataset - a combination of two audio DeepFakes and one anti-spoofing datasets that, thanks to the disjoint use of attacks, can lead to better generalization of detection methods. We present a thorough analysis of current DeepFake detection methods and consider different audio features (front-ends). In addition, we propose a model based on LCNN with LFCC and mel-spectrogram front-end, which not only is characterized by a good generalization and stability results but also shows improvement over LFCC-based mode - we decrease standard deviation on all folds and EER in two folds by up to 5%.

Zero-shot slot filling has received considerable attention to cope with the problem of limited available data for the target domain. One of the important factors in zero-shot learning is to make the model learn generalized and reliable representations. For this purpose, we present mcBERT, which stands for momentum contrastive learning with BERT, to develop a robust zero-shot slot filling model. mcBERT uses BERT to initialize the two encoders, the query encoder and key encoder, and is trained by applying momentum contrastive learning. Our experimental results on the SNIPS benchmark show that mcBERT substantially outperforms the previous models, recording a new state-of-the-art. Besides, we also show that each component composing mcBERT contributes to the performance improvement.

Deep learning experiments by Cohen et al. [2021] using deterministic Gradient Descent (GD) revealed an Edge of Stability (EoS) phase when learning rate (LR) and sharpness (i.e., the largest eigenvalue of Hessian) no longer behave as in traditional optimization. Sharpness stabilizes around $2/$LR and loss goes up and down across iterations, yet still with an overall downward trend. The current paper mathematically analyzes a new mechanism of implicit regularization in the EoS phase, whereby GD updates due to non-smooth loss landscape turn out to evolve along some deterministic flow on the manifold of minimum loss. This is in contrast to many previous results about implicit bias either relying on infinitesimal updates or noise in gradient. Formally, for any smooth function $L$ with certain regularity condition, this effect is demonstrated for (1) Normalized GD, i.e., GD with a varying LR $\eta_t =\frac{\eta}{|| \nabla L(x(t)) ||}$ and loss $L$; (2) GD with constant LR and loss $\sqrt{L- \min_x L(x)}$. Both provably enter the Edge of Stability, with the associated flow on the manifold minimizing $\lambda_{1}(\nabla^2 L)$. The above theoretical results have been corroborated by an experimental study.

Recent work has designed methods to demonstrate that model updates in ASR training can leak potentially sensitive attributes of the utterances used in computing the updates. In this work, we design the first method to demonstrate information leakage about training data from trained ASR models. We design Noise Masking, a fill-in-the-blank style method for extracting targeted parts of training data from trained ASR models. We demonstrate the success of Noise Masking by using it in four settings for extracting names from the LibriSpeech dataset used for training a state-of-the-art Conformer model. In particular, we show that we are able to extract the correct names from masked training utterances with 11.8% accuracy, while the model outputs some name from the train set 55.2% of the time. Further, we show that even in a setting that uses synthetic audio and partial transcripts from the test set, our method achieves 2.5% correct name accuracy (47.7% any name success rate). Lastly, we design Word Dropout, a data augmentation method that we show when used in training along with Multistyle TRaining (MTR), provides comparable utility as the baseline, along with significantly mitigating extraction via Noise Masking across the four evaluated settings.

Good initialization is essential for training Deep Neural Networks (DNNs). Oftentimes such initialization is found through a trial and error approach, which has to be applied anew every time an architecture is substantially modified, or inherited from smaller size networks leading to sub-optimal initialization. In this work we introduce a new and cheap algorithm, that allows one to find a good initialization automatically, for general feed-forward DNNs. The algorithm utilizes the Jacobian between adjacent network blocks to tune the network hyperparameters to criticality. We solve the dynamics of the algorithm for fully connected networks with ReLU and derive conditions for its convergence. We then extend the discussion to more general architectures with BatchNorm and residual connections. Finally, we apply our method to ResMLP and VGG architectures, where the automatic one-shot initialization found by our method shows good performance on vision tasks.

In medical image processing, the most important information is often located on small parts of the image. Patch-based approaches aim at using only the most relevant parts of the image. Finding ways to automatically select the patches is a challenge. In this paper, we investigate two criteria to choose patches: entropy and a spectral similarity criterion. We perform experiments at different levels of patch size. We train a Convolutional Neural Network on the subsets of patches and analyze the training time. We find that, in addition to requiring less preprocessing time, the classifiers trained on the datasets of patches selected based on entropy converge faster than on those selected based on the spectral similarity criterion and, furthermore, lead to higher accuracy. Moreover, patches of high entropy lead to faster convergence and better accuracy than patches of low entropy.

Early diagnosis of Alzheimer's disease (AD) is crucial in facilitating preventive care and delay progression. Speech based automatic AD screening systems provide a non-intrusive and more scalable alternative to other clinical screening techniques. Scarcity of such specialist data leads to uncertainty in both model selection and feature learning when developing such systems. To this end, this paper investigates the use of feature and model combination approaches to improve the robustness of domain fine-tuning of BERT and Roberta pre-trained text encoders on limited data, before the resulting embedding features being fed into an ensemble of backend classifiers to produce the final AD detection decision via majority voting. Experiments conducted on the ADReSS20 Challenge dataset suggest consistent performance improvements were obtained using model and feature combination in system development. State-of-the-art AD detection accuracies of 91.67 percent and 93.75 percent were obtained using manual and ASR speech transcripts respectively on the ADReSS20 test set consisting of 48 elderly speakers.

One of the main focuses in distributed learning is communication efficiency, since model aggregation at each round of training can consist of millions to billions of parameters. Several model compression methods, such as gradient quantization and sparsification, have been proposed to improve the communication efficiency of model aggregation. However, the information-theoretic minimum communication cost for a given distortion of gradient estimators is still unknown. In this paper, we study the fundamental limit of communication cost of model aggregation in distributed learning from a rate-distortion perspective. By formulating the model aggregation as a vector Gaussian CEO problem, we derive the rate region bound and sum-rate-distortion function for the model aggregation problem, which reveals the minimum communication rate at a particular gradient distortion upper bound. We also analyze the communication cost at each iteration and total communication cost based on the sum-rate-distortion function with the gradient statistics of real-world datasets. It is found that the communication gain by exploiting the correlation between worker nodes is significant for SignSGD, and a high distortion of gradient estimator can achieve low total communication cost in gradient compression.

The implicit stochastic gradient descent (ISGD), a proximal version of SGD, is gaining interest in the literature due to its stability over (explicit) SGD. In this paper, we conduct an in-depth analysis of the two modes of ISGD for smooth convex functions, namely proximal Robbins-Monro (proxRM) and proximal Poylak-Ruppert (proxPR) procedures, for their use in statistical inference on model parameters. Specifically, we derive non-asymptotic point estimation error bounds of both proxRM and proxPR iterates and their limiting distributions, and propose on-line estimators of their asymptotic covariance matrices that require only a single run of ISGD. The latter estimators are used to construct valid confidence intervals for the model parameters. Our analysis is free of the generalized linear model assumption that has limited the preceding analyses, and employs feasible procedures. Our on-line covariance matrix estimators appear to be the first of this kind in the ISGD literature.

Large sequence model (SM) such as GPT series and BERT has displayed outstanding performance and generalization capabilities on vision, language, and recently reinforcement learning tasks. A natural follow-up question is how to abstract multi-agent decision making into an SM problem and benefit from the prosperous development of SMs. In this paper, we introduce a novel architecture named Multi-Agent Transformer (MAT) that effectively casts cooperative multi-agent reinforcement learning (MARL) into SM problems wherein the task is to map agents' observation sequence to agents' optimal action sequence. Our goal is to build the bridge between MARL and SMs so that the modeling power of modern sequence models can be unleashed for MARL. Central to our MAT is an encoder-decoder architecture which leverages the multi-agent advantage decomposition theorem to transform the joint policy search problem into a sequential decision making process; this renders only linear time complexity for multi-agent problems and, most importantly, endows MAT with monotonic performance improvement guarantee. Unlike prior arts such as Decision Transformer fit only pre-collected offline data, MAT is trained by online trials and errors from the environment in an on-policy fashion. To validate MAT, we conduct extensive experiments on StarCraftII, Multi-Agent MuJoCo, Dexterous Hands Manipulation, and Google Research Football benchmarks. Results demonstrate that MAT achieves superior performance and data efficiency compared to strong baselines including MAPPO and HAPPO. Furthermore, we demonstrate that MAT is an excellent few-short learner on unseen tasks regardless of changes in the number of agents. See our project page at https://sites.google.com/view/multi-agent-transformer.

Deep learning models for verification systems often fail to generalize to new users and new environments, even though they learn highly discriminative features. To address this problem, we propose a few-shot domain generalization framework that learns to tackle distribution shift for new users and new domains. Our framework consists of domain-specific and domain-aggregation networks, which are the experts on specific and combined domains, respectively. By using these networks, we generate episodes that mimic the presence of both novel users and novel domains in the training phase to eventually produce better generalization. To save memory, we reduce the number of domain-specific networks by clustering similar domains together. Upon extensive evaluation on artificially generated noise domains, we can explicitly show generalization ability of our framework. In addition, we apply our proposed methods to the existing competitive architecture on the standard benchmark, which shows further performance improvements.

A variety of explanation methods have been proposed in recent years to help users gain insights into the results returned by neural networks, which are otherwise complex and opaque black-boxes. However, explanations give rise to potential side-channels that can be leveraged by an adversary for mounting attacks on the system. In particular, post-hoc explanation methods that highlight input dimensions according to their importance or relevance to the result also leak information that weakens security and privacy. In this work, we perform the first systematic characterization of the privacy and security risks arising from various popular explanation techniques. First, we propose novel explanation-guided black-box evasion attacks that lead to 10 times reduction in query count for the same success rate. We show that the adversarial advantage from explanations can be quantified as a reduction in the total variance of the estimated gradient. Second, we revisit the membership information leaked by common explanations. Contrary to observations in prior studies, via our modified attacks we show significant leakage of membership information (above 100% improvement over prior results), even in a much stricter black-box setting. Finally, we study explanation-guided model extraction attacks and demonstrate adversarial gains through a large reduction in query count.

Real-world applications of reinforcement learning for recommendation and experimentation faces a practical challenge: the relative reward of different bandit arms can evolve over the lifetime of the learning agent. To deal with these non-stationary cases, the agent must forget some historical knowledge, as it may no longer be relevant to minimise regret. We present a solution to handling non-stationarity that is suitable for deployment at scale, to provide business operators with automated adaptive optimisation. Our solution aims to provide interpretable learning that can be trusted by humans, whilst responding to non-stationarity to minimise regret. To this end, we develop an adaptive Bayesian learning agent that employs a novel form of dynamic memory. It enables interpretability through statistical hypothesis testing, by targeting a set point of statistical power when comparing rewards and adjusting its memory dynamically to achieve this power. By design, the agent is agnostic to different kinds of non-stationarity. Using numerical simulations, we compare its performance against an existing proposal and show that, under multiple non-stationary scenarios, our agent correctly adapts to real changes in the true rewards. In all bandit solutions, there is an explicit trade-off between learning and achieving maximal performance. Our solution sits on a different point on this trade-off when compared to another similarly robust approach: we prioritise interpretability, which relies on more learning, at the cost of some regret. We describe the architecture of a large-scale deployment of automatic optimisation-as-a-service where our agent achieves interpretability whilst adapting to changing circumstances.

Knowledge of search-landscape features of BlackBox Optimization (BBO) problems offers valuable information in light of the Algorithm Selection and/or Configuration problems. Exploratory Landscape Analysis (ELA) models have gained success in identifying predefined human-derived features and in facilitating portfolio selectors to address those challenges. Unlike ELA approaches, the current study proposes to transform the identification problem into an image recognition problem, with a potential to detect conception-free, machine-driven landscape features. To this end, we introduce the notion of Landscape Images, which enables us to generate imagery instances per a benchmark function, and then target the classification challenge over a diverse generalized dataset of functions. We address it as a supervised multi-class image recognition problem and apply basic artificial neural network models to solve it. The efficacy of our approach is numerically validated on the noise free BBOB and IOHprofiler benchmarking suites. This evident successful learning is another step toward automated feature extraction and local structure deduction of BBO problems. By using this definition of landscape images, and by capitalizing on existing capabilities of image recognition algorithms, we foresee the construction of an ImageNet-like library of functions for training generalized detectors that rely on machine-driven features.

The class imbalance problem is important and challenging. Ensemble approaches are widely used to tackle this problem because of their effectiveness. However, existing ensemble methods are always applied into original samples, while not considering the structure information among original samples. The limitation will prevent the imbalanced learning from being better. Besides, research shows that the structure information among samples includes local and global structure information. Based on the analysis above, an imbalanced ensemble algorithm with the deep sample pre-envelope network (DSEN) and local-global structure consistency mechanism (LGSCM) is proposed here to solve the problem.This algorithm can guarantee high-quality deep envelope samples for considering the local manifold and global structures information, which is helpful for imbalance learning. First, the deep sample envelope pre-network (DSEN) is designed to mine structure information among samples.Then, the local manifold structure metric (LMSM) and global structure distribution metric (GSDM) are designed to construct LGSCM to enhance distribution consistency of interlayer samples. Next, the DSEN and LGSCM are put together to form the final deep sample envelope network (DSEN-LG). After that, base classifiers are applied on the layers of deep samples respectively.Finally, the predictive results from base classifiers are fused through bagging ensemble learning mechanism. To demonstrate the effectiveness of the proposed method, forty-four public datasets and more than ten representative relevant algorithms are chosen for verification. The experimental results show that the algorithm is significantly better than other imbalanced ensemble algorithms.

Deep neural networks present impressive performance, yet they cannot reliably estimate their predictive confidence, limiting their applicability in high-risk domains. We show that applying a multi-label one-vs-all loss reveals classification ambiguity and reduces model overconfidence. The introduced SLOVA (Single Label One-Vs-All) model redefines typical one-vs-all predictive probabilities to a single label situation, where only one class is the correct answer. The proposed classifier is confident only if a single class has a high probability and other probabilities are negligible. Unlike the typical softmax function, SLOVA naturally detects out-of-distribution samples if the probabilities of all other classes are small. The model is additionally fine-tuned with exponential calibration, which allows us to precisely align the confidence score with model accuracy. We verify our approach on three tasks. First, we demonstrate that SLOVA is competitive with the state-of-the-art on in-distribution calibration. Second, the performance of SLOVA is robust under dataset shifts. Finally, our approach performs extremely well in the detection of out-of-distribution samples. Consequently, SLOVA is a tool that can be used in various applications where uncertainty modeling is required.

Kernel survival analysis models estimate individual survival distributions with the help of a kernel function, which measures the similarity between any two data points. Such a kernel function can be learned using deep kernel survival models. In this paper, we present a new deep kernel survival model called a survival kernet, which scales to large datasets in a manner that is amenable to model interpretation and also theoretical analysis. Specifically, the training data are partitioned into clusters based on a recently developed training set compression scheme for classification and regression called kernel netting that we extend to the survival analysis setting. At test-time, each data point is represented as a weighted combination of these clusters, and each such cluster can be visualized. For a special case of survival kernets, we establish a finite-sample error bound on predicted survival distributions that is, up to a log factor, optimal. Whereas scalability at test time is achieved using the aforementioned kernel netting compression strategy, scalability during training is achieved by a warm-start procedure based on tree ensembles such as XGBoost and a heuristic approach to accelerating neural architecture search. On three standard survival analysis datasets of varying sizes (up to roughly 3 million data points), we show that survival kernets are highly competitive with the best of baselines tested in terms of concordance index. Our code is available at: https://github.com/georgehc/survival-kernets

Social networks are often modeled using signed graphs, where vertices correspond to users and edges have a sign that indicates whether an interaction between users was positive or negative. The arising signed graphs typically contain a clear community structure in the sense that the graph can be partitioned into a small number of polarized communities, each defining a sparse cut and indivisible into smaller polarized sub-communities. We provide a local clustering oracle for signed graphs with such a clear community structure, that can answer membership queries, i.e., "Given a vertex $v$, which community does $v$ belong to?", in sublinear time by reading only a small portion of the graph. Formally, when the graph has bounded maximum degree and the number of communities is at most $O(\log n)$, then with $\tilde{O}(\sqrt{n}\operatorname{poly}(1/\varepsilon))$ preprocessing time, our oracle can answer each membership query in $\tilde{O}(\sqrt{n}\operatorname{poly}(1/\varepsilon))$ time, and it correctly classifies a $(1-\varepsilon)$-fraction of vertices w.r.t. a set of hidden planted ground-truth communities. Our oracle is desirable in applications where the clustering information is needed for only a small number of vertices. Previously, such local clustering oracles were only known for unsigned graphs; our generalization to signed graphs requires a number of new ideas and gives a novel spectral analysis of the behavior of random walks with signs. We evaluate our algorithm for constructing such an oracle and answering membership queries on both synthetic and real-world datasets, validating its performance in practice.

Short-term plasticity (STP) is a mechanism that stores decaying memories in synapses of the cerebral cortex. In computing practice, STP has been used, but mostly in the niche of spiking neurons, even though theory predicts that it is the optimal solution to certain dynamic tasks. Here we present a new type of recurrent neural unit, the STP Neuron (STPN), which indeed turns out strikingly powerful. Its key mechanism is that synapses have a state, propagated through time by a self-recurrent connection-within-the-synapse. This formulation enables training the plasticity with backpropagation through time, resulting in a form of learning to learn and forget in the short term. The STPN outperforms all tested alternatives, i.e. RNNs, LSTMs, other models with fast weights, and differentiable plasticity. We confirm this in both supervised and reinforcement learning (RL), and in tasks such as Associative Retrieval, Maze Exploration, Atari video games, and MuJoCo robotics. Moreover, we calculate that, in neuromorphic or biological circuits, the STPN minimizes energy consumption across models, as it depresses individual synapses dynamically. Based on these, biological STP may have been a strong evolutionary attractor that maximizes both efficiency and computational power. The STPN now brings these neuromorphic advantages also to a broad spectrum of machine learning practice. Code is available at https://github.com/NeuromorphicComputing/stpn

Vision Transformer (ViT) is becoming more popular in image processing. Specifically, we investigate the effectiveness of test-time adaptation (TTA) on ViT, a technique that has emerged to correct its prediction during test-time by itself. First, we benchmark various test-time adaptation approaches on ViT-B16 and ViT-L16. It is shown that the TTA is effective on ViT and the prior-convention (sensibly selecting modulation parameters) is not necessary when using proper loss function. Based on the observation, we propose a new test-time adaptation method called class-conditional feature alignment (CFA), which minimizes both the class-conditional distribution differences and the whole distribution differences of the hidden representation between the source and target in an online manner. Experiments of image classification tasks on common corruption (CIFAR-10-C, CIFAR-100-C, and ImageNet-C) and domain adaptation (digits datasets and ImageNet-Sketch) show that CFA stably outperforms the existing baselines on various datasets. We also verify that CFA is model agnostic by experimenting on ResNet, MLP-Mixer, and several ViT variants (ViT-AugReg, DeiT, and BeiT). Using BeiT backbone, CFA achieves 19.8% top-1 error rate on ImageNet-C, outperforming the existing test-time adaptation baseline 44.0%. This is a state-of-the-art result among TTA methods that do not need to alter training phase.

Dexterous manipulation with a multi-finger hand is one of the most challenging problems in robotics. While recent progress in imitation learning has largely improved the sample efficiency compared to Reinforcement Learning, the learned policy can hardly generalize to manipulate novel objects, given limited expert demonstrations. In this paper, we propose to learn dexterous manipulation using large-scale demonstrations with diverse 3D objects in a category, which are generated from a human grasp affordance model. This generalizes the policy to novel object instances within the same category. To train the policy, we propose a novel imitation learning objective jointly with a geometric representation learning objective using our demonstrations. By experimenting with relocating diverse objects in simulation, we show that our approach outperforms baselines with a large margin when manipulating novel objects. We also ablate the importance on 3D object representation learning for manipulation. We include videos, code, and additional information on the project website - https://kristery.github.io/ILAD/ .

A long-held objective in AI is to build systems that understand concepts in a humanlike way. Setting aside the difficulty of building such a system, even trying to evaluate one is a challenge, due to present-day AI's relative opacity and its proclivity for finding shortcut solutions. This is exacerbated by humans' tendency to anthropomorphize, assuming that a system that can recognize one instance of a concept must also understand other instances, as a human would. In this paper, we argue that understanding a concept requires the ability to use it in varied contexts. Accordingly, we propose systematic evaluations centered around concepts, by probing a system's ability to use a given concept in many different instantiations. We present case studies of such an evaluations on two domains -- RAVEN (inspired by Raven's Progressive Matrices) and the Abstraction and Reasoning Corpus (ARC) -- that have been used to develop and assess abstraction abilities in AI systems. Our concept-based approach to evaluation reveals information about AI systems that conventional test sets would have left hidden.

Despite the remarkable success of Generative Adversarial Networks (GANs) on text, images, and videos, generating high-quality tabular data is still under development owing to some unique challenges such as capturing dependencies in imbalanced data, optimizing the quality of synthetic patient data while preserving privacy. In this paper, we propose DP-CGANS, a differentially private conditional GAN framework consisting of data transformation, sampling, conditioning, and networks training to generate realistic and privacy-preserving tabular data. DP-CGANS distinguishes categorical and continuous variables and transforms them to latent space separately. Then, we structure a conditional vector as an additional input to not only presents the minority class in the imbalanced data, but also capture the dependency between variables. We inject statistical noise to the gradients in the networking training process of DP-CGANS to provide a differential privacy guarantee. We extensively evaluate our model with state-of-the-art generative models on three public datasets and two real-world personal health datasets in terms of statistical similarity, machine learning performance, and privacy measurement. We demonstrate that our model outperforms other comparable models, especially in capturing dependency between variables. Finally, we present the balance between data utility and privacy in synthetic data generation considering the different data structure and characteristics of real-world datasets such as imbalance variables, abnormal distributions, and sparsity of data.

The paper introduces a method to construct confidence bands for bounded, band-limited functions based on a finite sample of input-output pairs. The approach is distribution-free w.r.t. the observation noises and only the knowledge of the input distribution is assumed. It is nonparametric, that is, it does not require a parametric model of the regression function and the regions have non-asymptotic guarantees. The algorithm is based on the theory of Paley-Wiener reproducing kernel Hilbert spaces. The paper first studies the fully observable variant, when there are no noises on the observations and only the inputs are random; then it generalizes the ideas to the noisy case using gradient-perturbation methods. Finally, numerical experiments demonstrating both cases are presented.

End-to-end (E2E) models are often being accompanied by language models (LMs) via shallow fusion for boosting their overall quality as well as recognition of rare words. At the same time, several prior works show that LMs are susceptible to unintentionally memorizing rare or unique sequences in the training data. In this work, we design a framework for detecting memorization of random textual sequences (which we call canaries) in the LM training data when one has only black-box (query) access to LM-fused speech recognizer, as opposed to direct access to the LM. On a production-grade Conformer RNN-T E2E model fused with a Transformer LM, we show that detecting memorization of singly-occurring canaries from the LM training data of 300M examples is possible. Motivated to protect privacy, we also show that such memorization gets significantly reduced by per-example gradient-clipped LM training without compromising overall quality.

Real-world sequential decision making requires data-driven algorithms that provide practical guarantees on performance throughout training while also making efficient use of data. Model-free deep reinforcement learning represents a framework for such data-driven decision making, but existing algorithms typically only focus on one of these goals while sacrificing performance with respect to the other. On-policy algorithms guarantee policy improvement throughout training but suffer from high sample complexity, while off-policy algorithms make efficient use of data through sample reuse but lack theoretical guarantees. In order to balance these competing goals, we develop a class of Generalized Policy Improvement algorithms that combines the policy improvement guarantees of on-policy methods with the efficiency of theoretically supported sample reuse. We demonstrate the benefits of this new class of algorithms through extensive experimental analysis on a variety of continuous control tasks from the DeepMind Control Suite.

Graph Neural Networks (GNNs) have drawn tremendous attention due to their unique capability to extend Machine Learning (ML) approaches to applications broadly-defined as having unstructured data, especially graphs. Compared with other Machine Learning (ML) modalities, the acceleration of Graph Neural Networks (GNNs) is more challenging due to the irregularity and heterogeneity derived from graph typologies. Existing efforts, however, have focused mainly on handling graphs' irregularity and have not studied their heterogeneity. To this end we propose H-GCN, a PL (Programmable Logic) and AIE (AI Engine) based hybrid accelerator that leverages the emerging heterogeneity of Xilinx Versal Adaptive Compute Acceleration Platforms (ACAPs) to achieve high-performance GNN inference. In particular, H-GCN partitions each graph into three subgraphs based on its inherent heterogeneity, and processes them using PL and AIE, respectively. To further improve performance, we explore the sparsity support of AIE and develop an efficient density-aware method to automatically map tiles of sparse matrix-matrix multiplication (SpMM) onto the systolic tensor array. Compared with state-of-the-art GCN accelerators, H-GCN achieves, on average, speedups of 1.1~2.3X.  ( 2 min )

Recently, the application of deep learning models to diagnose neuropsychiatric diseases from brain imaging data has received more and more attention. However, in practice, exploring interactions in brain functional connectivity based on operational magnetic resonance imaging data is critical for studying mental illness. Since Attention-Deficit and Hyperactivity Disorder (ADHD) is a type of chronic disease that is very difficult to diagnose in the early stages, it is necessary to improve the diagnosis accuracy of such illness using machine learning models treating patients before the critical condition. In this study, we utilize the dynamics of brain functional connectivity to model features from medical imaging data, which can extract the differences in brain function interactions between Normal Control (NC) and ADHD. To meet that requirement, we employ the Bayesian connectivity change-point model to detect brain dynamics using the local binary encoding approach and kernel hierarchical extreme learning machine for classifying features. To verify our model, we experimented with it on several real-world children's datasets, and our results achieved superior classification rates compared to the state-of-the-art models.  ( 2 min )

The task of ranking individuals or teams, based on a set of comparisons between pairs, arises in various contexts, including sporting competitions and the analysis of dominance hierarchies among animals and humans. Given data on which competitors beat which others, the challenge is to rank the competitors from best to worst. Here we study the problem of computing rankings when there are multiple, potentially conflicting modes of comparison, such as multiple types of dominance behaviors among animals. We assume that we do not know a priori what information each behavior conveys about the ranking, or even whether they convey any information at all. Nonetheless we show that it is possible to compute a ranking in this situation and present a fast method for doing so, based on a combination of an expectation-maximization algorithm and a modified Bradley-Terry model. We give a selection of example applications to both animal and human competition.  ( 2 min )

Koopman operators model nonlinear dynamics as a linear dynamic system acting on a nonlinear function as the state. This nonstandard state is often called a Koopman observable and is usually approximated numerically by a superposition of functions drawn from a \textit{dictionary}. A widely used algorithm, is \textit{Extended Dynamic Mode Decomposition}, where the dictionary functions are drawn from a fixed, homogeneous class of functions. Recently, deep learning combined with EDMD has been used to learn novel dictionary functions in an algorithm called deep dynamic mode decomposition (deepDMD). The learned representation both (1) accurately models and (2) scales well with the dimension of the original nonlinear system. In this paper we analyze the learned dictionaries from deepDMD and explore the theoretical basis for their strong performance. We discover a novel class of dictionary functions to approximate Koopman observables. Error analysis of these dictionary functions show they satisfy a property of subspace approximation, which we define as uniform finite approximate closure. We discover that structured mixing of heterogeneous dictionary functions drawn from different classes of nonlinear functions achieve the same accuracy and dimensional scaling as deepDMD. This mixed dictionary does so with an order of magnitude reduction in parameters, while maintaining geometric interpretability. Our results provide a hypothesis to explain the success of deep neural networks in learning numerical approximations to Koopman operators.  ( 3 min )

While notable progress has been made in specifying and learning objectives for general cyber-physical systems, applying these methods to distributed multi-agent systems still pose significant challenges. Among these are the need to (a) craft specification primitives that allow expression and interplay of both local and global objectives, (b) tame explosion in the state and action spaces to enable effective learning, and (c) minimize coordination frequency and the set of engaged participants for global objectives. To address these challenges, we propose a novel specification framework that allows natural composition of local and global objectives used to guide training of a multi-agent system. Our technique enables learning expressive policies that allow agents to operate in a coordination-free manner for local objectives, while using a decentralized communication protocol for enforcing global ones. Experimental results support our claim that sophisticated multi-agent distributed planning problems can be effectively realized using specification-guided learning.  ( 2 min )

We propose an approach to extract speaker embeddings that are robust to speaking style variations in text-independent speaker verification. Typically, speaker embedding extraction includes training a DNN for speaker classification and using the bottleneck features as speaker representations. Such a network has a pooling layer to transform frame-level to utterance-level features by calculating statistics over all utterance frames, with equal weighting. However, self-attentive embeddings perform weighted pooling such that the weights correspond to the importance of the frames in a speaker classification task. Entropy can capture acoustic variability due to speaking style variations. Hence, an entropy-based variable frame rate vector is proposed as an external conditioning vector for the self-attention layer to provide the network with information that can address style effects. This work explores five different approaches to conditioning. The best conditioning approach, concatenation with gating, provided statistically significant improvements over the x-vector baseline in 12/23 tasks and was the same as the baseline in 11/23 tasks when using the UCLA speaker variability database. It also significantly outperformed self-attention without conditioning in 9/23 tasks and was worse in 1/23. The method also showed significant improvements in multi-speaker scenarios of SITW.  ( 2 min )

Attention-based models trained on protein sequences have demonstrated incredible success at classification and generation tasks relevant for artificial intelligence-driven protein design. However, we lack a sufficient understanding of how very large-scale models and data play a role in effective protein model development. We introduce a suite of protein language models, named ProGen2, that are scaled up to 6.4B parameters and trained on different sequence datasets drawn from over a billion proteins from genomic, metagenomic, and immune repertoire databases. ProGen2 models show state-of-the-art performance in capturing the distribution of observed evolutionary sequences, generating novel viable sequences, and predicting protein fitness without additional finetuning. As large model sizes and raw numbers of protein sequences continue to become more widely accessible, our results suggest that a growing emphasis needs to be placed on the data distribution provided to a protein sequence model. We release the ProGen2 models and code at https://github.com/salesforce/progen.  ( 2 min )

Signal measurement appearing in the form of time series is one of the most common types of data used in medical machine learning applications. Such datasets are often small in size, expensive to collect and annotate, and might involve privacy issues, which hinders our ability to train large, state-of-the-art deep learning models for biomedical applications. For time-series data, the suite of data augmentation strategies we can use to expand the size of the dataset is limited by the need to maintain the basic properties of the signal. Generative Adversarial Networks (GANs) can be utilized as another data augmentation tool. In this paper, we present TTS-CGAN, a transformer-based conditional GAN model that can be trained on existing multi-class datasets and generate class-specific synthetic time-series sequences of arbitrary length. We elaborate on the model architecture and design strategies. Synthetic sequences generated by our model are indistinguishable from real ones, and can be used to complement or replace real signals of the same type, thus achieving the goal of data augmentation. To evaluate the quality of the generated data, we modify the wavelet coherence metric to be able to compare the similarity between two sets of signals, and also conduct a case study where a mix of synthetic and real data are used to train a deep learning model for sequence classification. Together with other visualization techniques and qualitative evaluation approaches, we demonstrate that TTS-CGAN generated synthetic data are similar to real data, and that our model performs better than the other state-of-the-art GAN models built for time-series data generation.  ( 3 min )

We study stochastic online resource allocation: a decision maker needs to allocate limited resources to stochastically-generated sequentially-arriving requests in order to maximize reward. Motivated by practice, we consider a data-driven setting in which requests are drawn independently from a distribution that is unknown to the decision maker. Online resource allocation and its special cases have been studied extensively in the past, but these previous results crucially and universally rely on a practically-untenable assumption: the total number of requests (the horizon) is known to the decision maker in advance. In many applications, such as revenue management and online advertising, the number of requests can vary widely because of fluctuations in demand or user traffic intensity. In this work, we develop online algorithms that are robust to horizon uncertainty. In sharp contrast to the known-horizon setting, we show that no algorithm can achieve a constant asymptotic competitive ratio that is independent of the horizon uncertainty. We then introduce a novel algorithm that combines dual mirror descent with a carefully-chosen target consumption sequence and prove that it achieves a bounded competitive ratio. Our algorithm is near-optimal in the sense that its competitive ratio attains the optimal rate of growth when the horizon uncertainty grows large.  ( 2 min )

Data poisoning attacks aim at manipulating model behaviors through distorting training data. Previously, an aggregation-based certified defense, Deep Partition Aggregation (DPA), was proposed to mitigate this threat. DPA predicts through an aggregation of base classifiers trained on disjoint subsets of data, thus restricting its sensitivity to dataset distortions. In this work, we propose an improved certified defense against general poisoning attacks, namely Finite Aggregation. In contrast to DPA, which directly splits the training set into disjoint subsets, our method first splits the training set into smaller disjoint subsets and then combines duplicates of them to build larger (but not disjoint) subsets for training base classifiers. This reduces the worst-case impacts of poison samples and thus improves certified robustness bounds. In addition, we offer an alternative view of our method, bridging the designs of deterministic and stochastic aggregation-based certified defenses. Empirically, our proposed Finite Aggregation consistently improves certificates on MNIST, CIFAR-10, and GTSRB, boosting certified fractions by up to 3.05%, 3.87% and 4.77%, respectively, while keeping the same clean accuracies as DPA's, effectively establishing a new state of the art in (pointwise) certified robustness against data poisoning.

Kernel survival analysis models estimate individual survival distributions with the help of a kernel function, which measures the similarity between any two data points. Such a kernel function can be learned using deep kernel survival models. In this paper, we present a new deep kernel survival model called a survival kernet, which scales to large datasets in a manner that is amenable to model interpretation and also theoretical analysis. Specifically, the training data are partitioned into clusters based on a recently developed training set compression scheme for classification and regression called kernel netting that we extend to the survival analysis setting. At test-time, each data point is represented as a weighted combination of these clusters, and each such cluster can be visualized. For a special case of survival kernets, we establish a finite-sample error bound on predicted survival distributions that is, up to a log factor, optimal. Whereas scalability at test time is achieved using the aforementioned kernel netting compression strategy, scalability during training is achieved by a warm-start procedure based on tree ensembles such as XGBoost and a heuristic approach to accelerating neural architecture search. On three standard survival analysis datasets of varying sizes (up to roughly 3 million data points), we show that survival kernets are highly competitive with the best of baselines tested in terms of concordance index. Our code is available at: https://github.com/georgehc/survival-kernets

One of the main focuses in distributed learning is communication efficiency, since model aggregation at each round of training can consist of millions to billions of parameters. Several model compression methods, such as gradient quantization and sparsification, have been proposed to improve the communication efficiency of model aggregation. However, the information-theoretic minimum communication cost for a given distortion of gradient estimators is still unknown. In this paper, we study the fundamental limit of communication cost of model aggregation in distributed learning from a rate-distortion perspective. By formulating the model aggregation as a vector Gaussian CEO problem, we derive the rate region bound and sum-rate-distortion function for the model aggregation problem, which reveals the minimum communication rate at a particular gradient distortion upper bound. We also analyze the communication cost at each iteration and total communication cost based on the sum-rate-distortion function with the gradient statistics of real-world datasets. It is found that the communication gain by exploiting the correlation between worker nodes is significant for SignSGD, and a high distortion of gradient estimator can achieve low total communication cost in gradient compression.

In medicine, survival analysis studies the time duration to events of interest such as mortality. One major challenge is how to deal with multiple competing events (e.g., multiple disease diagnoses). In this work, we propose a transformer-based model that does not make the assumption for the underlying survival distribution and is capable of handling competing events, namely SurvTRACE. We account for the implicit \emph{confounders} in the observational setting in multi-events scenarios, which causes selection bias as the predicted survival probability is influenced by irrelevant factors. To sufficiently utilize the survival data to train transformers from scratch, multiple auxiliary tasks are designed for multi-task learning. The model hence learns a strong shared representation from all these tasks and in turn serves for better survival analysis. We further demonstrate how to inspect the covariate relevance and importance through interpretable attention mechanisms of SurvTRACE, which suffices to great potential in enhancing clinical trial design and new treatment development. Experiments on METABRIC, SUPPORT, and SEER data with 470k patients validate the all-around superiority of our method.

In compressed sensing, the goal is to reconstruct the signal from an underdetermined system of linear measurements. Thus, prior knowledge about the signal of interest and its structure is required. Additionally, in many scenarios, the signal has an unknown orientation prior to measurements. To address such recovery problems, we propose using equivariant generative models as a prior, which encapsulate orientation information in their latent space. Thereby, we show that signals with unknown orientations can be recovered with iterative gradient descent on the latent space of these models and provide additional theoretical recovery guarantees. We construct an equivariant variational autoencoder and use the decoder as generative prior for compressed sensing. We discuss additional potential gains of the proposed approach in terms of convergence and latency.

The tremendous recent progress in analyzing the training dynamics of overparameterized neural networks has primarily focused on wide networks and therefore does not sufficiently address the role of depth in deep learning. In this work, we present the first trainability guarantee of infinitely deep but narrow neural networks. We study the infinite-depth limit of a multilayer perceptron (MLP) with a specific initialization and establish a trainability guarantee using the NTK theory. We then extend the analysis to an infinitely deep convolutional neural network (CNN) and perform brief experiments.

We pursue a line of research that seeks to regularize the spectral norm of the Jacobian of the input-output mapping for deep neural networks. While previous work rely on upper bounding techniques, we provide a scheme that targets the exact spectral norm. We showcase that our algorithm achieves an improved generalization performance compared to previous spectral regularization techniques while simultaneously maintaining a strong safeguard against natural and adversarial noise. Moreover, we further explore some previous reasoning concerning the strong adversarial protection that Jacobian regularization provides and show that it can be misleading.

In most data-scientific approaches, the principle of Maximum Entropy (MaxEnt) is used to a posteriori justify some parametric model which has been already chosen based on experience, prior knowledge or computational simplicity. In a perpendicular formulation to conventional model building, we start from the linear system of phenomenological constraints and asymptotically derive the distribution over all viable distributions that satisfy the provided set of constraints. The MaxEnt distribution plays a special role, as it is the most typical among all phenomenologically viable distributions representing a good expansion point for large-N techniques. This enables us to consistently formulate hypothesis testing in a fully-data driven manner. The appropriate parametric model which is supported by the data can be always deduced at the end of model selection. In the MaxEnt framework, we recover major scores and selection procedures used in multiple applications and assess their ability to capture associations in the data-generating process and identify the most generalizable model. This data-driven counterpart of standard model selection demonstrates the unifying prospective of the deductive logic advocated by MaxEnt principle, while potentially shedding new insights to the inverse problem.

Interest in understanding and factorizing learned embedding spaces is growing. For instance, recent concept-based explanation techniques analyze a machine learning model in terms of interpretable latent components. Such components have to be discovered in the model's embedding space, e.g., through independent component analysis (ICA) or modern disentanglement learning techniques. While these unsupervised approaches offer a sound formal framework, they either require access to a data generating function or impose rigid assumptions on the data distribution, such as independence of components, that are often violated in practice. In this work, we link conceptual explainability for vision models with disentanglement learning and ICA. This enables us to provide first theoretical results on how components can be identified without requiring any distributional assumptions. From these insights, we derive the disjoint attributions (DA) concept discovery method that is applicable to a broader class of problems than current approaches but yet possesses a formal identifiability guarantee. In an extensive comparison against component analysis and over 300 state-of-the-art disentanglement models, DA stably maintains superior performance, even under varying distributions and correlation strengths.

Our goal is to quantify whether, and if so how, spatio-temporal patterns in tropical cyclone (TC) satellite imagery signal an upcoming rapid intensity change event. To address this question, we propose a new nonparametric test of association between a time series of images and a series of binary event labels. We ask whether there is a difference in distribution between (dependent but identically distributed) 24-h sequences of images preceding an event versus a non-event. By rewriting the statistical test as a regression problem, we leverage neural networks to infer modes of structural evolution of TC convection that are representative of the lead-up to rapid intensity change events. Dependencies between nearby sequences are handled by a bootstrap procedure that estimates the marginal distribution of the label series. We prove that type I error control is guaranteed as long as the distribution of the label series is well-estimated, which is made easier by the extensive historical data for binary TC event labels. We show empirical evidence that our proposed method identifies archetypes of infrared imagery associated with elevated rapid intensification risk, typically marked by deep or deepening core convection over time. Such results provide a foundation for improved forecasts of rapid intensification.

We study the problem of average-reward Markov decision processes (AMDPs) and develop novel first-order methods with strong theoretical guarantees for both policy evaluation and optimization. Existing on-policy evaluation methods suffer from sub-optimal convergence rates as well as failure in handling insufficiently random policies, e.g., deterministic policies, for lack of exploration. To remedy these issues, we develop a novel variance-reduced temporal difference (VRTD) method with linear function approximation for randomized policies along with optimal convergence guarantees, and an exploratory variance-reduced temporal difference (EVRTD) method for insufficiently random policies with comparable convergence guarantees. We further establish linear convergence rate on the bias of policy evaluation, which is essential for improving the overall sample complexity of policy optimization. On the other hand, compared with intensive research interest in finite sample analysis of policy gradient methods for discounted MDPs, existing studies on policy gradient methods for AMDPs mostly focus on regret bounds under restrictive assumptions on the underlying Markov processes (see, e.g., Abbasi-Yadkori et al., 2019), and they often lack guarantees on the overall sample complexities. Towards this end, we develop an average-reward variant of the stochastic policy mirror descent (SPMD) (Lan, 2022). We establish the first $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity for solving AMDPs with policy gradient method under both the generative model (with unichain assumption) and Markovian noise model (with ergodic assumption). This bound can be further improved to $\widetilde{\mathcal{O}}(\epsilon^{-1})$ for solving regularized AMDPs. Our theoretical advantages are corroborated by numerical experiments.

We introduce a new online algorithm for expected log-likelihood maximization in situations where the objective function is multi-modal and/or has saddle points, that we term G-PFSO. The key element underpinning G-PFSO is a probability distribution which (a) is shown to concentrate on the target parameter value as the sample size increases and (b) can be efficiently estimated by means of a standard particle filter algorithm. This distribution depends on a learning rate, where the faster the learning rate the quicker it concentrates on the desired element of the search space, but the less likely G-PFSO is to escape from a local optimum of the objective function. In order to achieve a fast convergence rate with a slow learning rate, G-PFSO exploits the acceleration property of averaging, well-known in the stochastic gradient literature. Considering several challenging estimation problems, the numerical experiments show that, with high probability, G-PFSO successfully finds the highest mode of the objective function and converges to its global maximizer at the optimal rate. While the focus of this work is expected log-likelihood maximization, the proposed methodology and its theory apply more generally for optimizing a function defined through an expectation.

Sample-efficiency guarantees for offline reinforcement learning (RL) often rely on strong assumptions on both the function classes (e.g., Bellman-completeness) and the data coverage (e.g., all-policy concentrability). Despite the recent efforts on relaxing these assumptions, existing works are only able to relax one of the two factors, leaving the strong assumption on the other factor intact. As an important open problem, can we achieve sample-efficient offline RL with weak assumptions on both factors? In this paper we answer the question in the positive. We analyze a simple algorithm based on the primal-dual formulation of MDPs, where the dual variables (discounted occupancy) are modeled using a density-ratio function against offline data. With proper regularization, we show that the algorithm enjoys polynomial sample complexity, under only realizability and single-policy concentrability. We also provide alternative analyses based on different assumptions to shed light on the nature of primal-dual algorithms for offline RL.

The estimation of time-varying quantities is a fundamental component of decision making in fields such as healthcare and finance. However, the practical utility of such estimates is limited by how accurately they quantify predictive uncertainty. In this work, we address the problem of estimating the joint predictive distribution of high-dimensional multivariate time series. We propose a versatile method, based on the transformer architecture, that estimates joint distributions using an attention-based decoder that provably learns to mimic the properties of non-parametric copulas. The resulting model has several desirable properties: it can scale to hundreds of time series, supports both forecasting and interpolation, can handle unaligned and non-uniformly sampled data, and can seamlessly adapt to missing data during training. We demonstrate these properties empirically and show that our model produces state-of-the-art predictions on multiple real-world datasets.

This paper considers the problem of measure estimation under the barycentric coding model (BCM), in which an unknown measure is assumed to belong to the set of Wasserstein-2 barycenters of a finite set of known measures. Estimating a measure under this model is equivalent to estimating the unknown barycentric coordinates. We provide novel geometrical, statistical, and computational insights for measure estimation under the BCM, consisting of three main results. Our first main result leverages the Riemannian geometry of Wasserstein-2 space to provide a procedure for recovering the barycentric coordinates as the solution to a quadratic optimization problem assuming access to the true reference measures. The essential geometric insight is that the parameters of this quadratic problem are determined by inner products between the optimal displacement maps from the given measure to the reference measures defining the BCM. Our second main result then establishes an algorithm for solving for the coordinates in the BCM when all the measures are observed empirically via i.i.d. samples. We prove precise rates of convergence for this algorithm -- determined by the smoothness of the underlying measures and their dimensionality -- thereby guaranteeing its statistical consistency. Finally, we demonstrate the utility of the BCM and associated estimation procedures in three application areas: (i) covariance estimation for Gaussian measures; (ii) image processing; and (iii) natural language processing.

We train an LSTM network based on a pooled dataset made of hundreds of liquid stocks aiming to forecast the next daily realized volatility for all stocks. Showing the consistent outperformance of this universal LSTM relative to other asset-specific parametric models, we uncover nonparametric evidences of a universal volatility formation mechanism across assets relating past market realizations, including daily returns and volatilities, to current volatilities. A parsimonious parametric forecasting device combining the rough fractional stochastic volatility and quadratic rough Heston models with fixed parameters results in the same level of performance as the universal LSTM, which confirms the universality of the volatility formation process from a parametric perspective.

We consider the distributed SGD problem, where a main node distributes gradient calculations among $n$ workers. By assigning tasks to all the workers and waiting only for the $k$ fastest ones, the main node can trade-off the algorithm's error with its runtime by gradually increasing $k$ as the algorithm evolves. However, this strategy, referred to as adaptive $k$-sync, neglects the cost of unused computations and of communicating models to workers that reveal a straggling behavior. We propose a cost-efficient scheme that assigns tasks only to $k$ workers, and gradually increases $k$. We introduce the use of a combinatorial multi-armed bandit model to learn which workers are the fastest while assigning gradient calculations. Assuming workers with exponentially distributed response times parameterized by different means, we give empirical and theoretical guarantees on the regret of our strategy, i.e., the extra time spent to learn the mean response times of the workers. Furthermore, we propose and analyze a strategy applicable to a large class of response time distributions. Compared to adaptive $k$-sync, our scheme achieves significantly lower errors with the same computational efforts and less downlink communication while being inferior in terms of speed.

We propose a general formulation for continuous treatment recommendation problems in settings with clinical survival data, which we call the Deep Survival Dose Response Function (DeepSDRF). That is, we consider the problem of learning the conditional average dose response (CADR) function solely from historical data in which observed factors (confounders) affect both observed treatment and time-to-event outcomes. The estimated treatment effect from DeepSDRF enables us to develop recommender algorithms with the correction for selection bias. We compared two recommender approaches based on random search and reinforcement learning and found similar performance in terms of patient outcome. We tested the DeepSDRF and the corresponding recommender on extensive simulation studies and the eICU Research Institute (eRI) database. To the best of our knowledge, this is the first time that causal models are used to address the continuous treatment effect with observational data in a medical context.

The increasing complexity of today's software requires the contribution of thousands of developers. This complex collaboration structure makes developers more likely to introduce defect-prone changes that lead to software faults. Determining when these defect-prone changes are introduced has proven challenging, and using traditional machine learning (ML) methods to make these determinations seems to have reached a plateau. In this work, we build contribution graphs consisting of developers and source files to capture the nuanced complexity of changes required to build software. By leveraging these contribution graphs, our research shows the potential of using graph-based ML to improve Just-In-Time (JIT) defect prediction. We hypothesize that features extracted from the contribution graphs may be better predictors of defect-prone changes than intrinsic features derived from software characteristics. We corroborate our hypothesis using graph-based ML for classifying edges that represent defect-prone changes. This new framing of the JIT defect prediction problem leads to remarkably better results. We test our approach on 14 open-source projects and show that our best model can predict whether or not a code change will lead to a defect with an F1 score as high as 77.55$\%$. This represents an increase of as much as 46.72$\%$ over the state-of-the-art in JIT defect prediction. We describe limitations, open challenges, and how this method can be used for operational JIT defect prediction.

Cloud-based software has many advantages. When services are divided into many independent components, they are easier to update. Also, during peak demand, it is easier to scale cloud services (just hire more CPUs). Hence, many organizations are partitioning their monolithic enterprise applications into cloud-based microservices. Recently there has been much work using machine learning to simplify this partitioning task. Despite much research, no single partitioning method can be recommended as generally useful. More specifically, those prior solutions are "brittle"; i.e. if they work well for one kind of goal in one dataset, then they can be sub-optimal if applied to many datasets and multiple goals. In order to find a generally useful partitioning method, we propose DEEPLY. This new algorithm extends the CO-GCN deep learning partition generator with (a) a novel loss function and (b) some hyper-parameter optimization. As shown by our experiments, DEEPLY generally outperforms prior work (including CO-GCN, and others) across multiple datasets and goals. To the best of our knowledge, this is the first report in SE of such stable hyper-parameter optimization. To aid reuse of this work, DEEPLY is available on-line at https://bit.ly/2WhfFlB.

Real-world sequential decision making requires data-driven algorithms that provide practical guarantees on performance throughout training while also making efficient use of data. Model-free deep reinforcement learning represents a framework for such data-driven decision making, but existing algorithms typically only focus on one of these goals while sacrificing performance with respect to the other. On-policy algorithms guarantee policy improvement throughout training but suffer from high sample complexity, while off-policy algorithms make efficient use of data through sample reuse but lack theoretical guarantees. In order to balance these competing goals, we develop a class of Generalized Policy Improvement algorithms that combines the policy improvement guarantees of on-policy methods with the efficiency of theoretically supported sample reuse. We demonstrate the benefits of this new class of algorithms through extensive experimental analysis on a variety of continuous control tasks from the DeepMind Control Suite.

Numerical validation is at the core of machine learning research as it allows to assess the actual impact of new methods, and to confirm the agreement between theory and practice. Yet, the rapid development of the field poses several challenges: researchers are confronted with a profusion of methods to compare, limited transparency and consensus on best practices, as well as tedious re-implementation work. As a result, validation is often very partial, which can lead to wrong conclusions that slow down the progress of research. We propose Benchopt, a collaborative framework to automate, reproduce and publish optimization benchmarks in machine learning across programming languages and hardware architectures. Benchopt simplifies benchmarking for the community by providing an off-the-shelf tool for running, sharing and extending experiments. To demonstrate its broad usability, we showcase benchmarks on three standard learning tasks: $\ell_2$-regularized logistic regression, Lasso, and ResNet18 training for image classification. These benchmarks highlight key practical findings that give a more nuanced view of the state-of-the-art for these problems, showing that for practical evaluation, the devil is in the details. We hope that Benchopt will foster collaborative work in the community hence improving the reproducibility of research findings.

There exist well-developed frameworks for causal modelling, but these require rather a lot of human domain expertise to define causal variables and perform interventions. In order to enable autonomous agents to learn abstract causal models through interactive experience, the existing theoretical foundations need to be extended and clarified. Existing frameworks give no guidance regarding variable choice / representation, and more importantly, give no indication as to which behaviour policies or physical transformations of state space shall count as interventions. The framework sketched in this paper describes actions as transformations of state space, for instance induced by an agent running a policy. This makes it possible to describe in a uniform way both transformations of the micro-state space and abstract models thereof, and say when the latter is veridical / grounded / natural. We then introduce (causal) variables, define a mechanism as an invariant predictor, and say when an action can be viewed as a ``surgical intervention'', thus bringing the objective of causal representation & intervention skill learning into clearer focus.

In many computational problems in engineering and science, function or model differentiation is essential, but also integration is needed. An important class of computational problems include so-called integro-differential equations which include both integrals and derivatives of a function. In another example, stochastic differential equations can be written in terms of a partial differential equation of a probability density function of the stochastic variable. To learn characteristics of the stochastic variable based on the density function, specific integral transforms, namely moments, of the density function need to be calculated. Recently, the machine learning paradigm of Physics-Informed Neural Networks emerged with increasing popularity as a method to solve differential equations by leveraging automatic differentiation. In this work, we propose to augment the paradigm of Physics-Informed Neural Networks with automatic integration in order to compute complex integral transforms on trained solutions, and to solve integro-differential equations where integrals are computed on-the-fly during training. Furthermore, we showcase the techniques in various application settings, numerically simulating quantum computer-based neural networks as well as classical neural networks.

Standard uniform convergence results bound the generalization gap of the expected loss over a hypothesis class. The emergence of risk-sensitive learning requires generalization guarantees for functionals of the loss distribution beyond the expectation. While prior works specialize in uniform convergence of particular functionals, our work provides uniform convergence for a general class of H\"older risk functionals for which the closeness in the Cumulative Distribution Function (CDF) entails closeness in risk. We establish the first uniform convergence results for estimating the CDF of the loss distribution, yielding guarantees that hold simultaneously both over all H\"older risk functionals and over all hypotheses. Thus licensed to perform empirical risk minimization, we develop practical gradient-based methods for minimizing distortion risks (widely studied subset of H\"older risks that subsumes the spectral risks, including the mean, conditional value at risk, cumulative prospect theory risks, and others) and provide convergence guarantees. In experiments, we demonstrate the efficacy of our learning procedure, both in settings where uniform convergence results hold and in high-dimensional settings with deep networks.

While the primary goal of the exploration phase in reward-free reinforcement learning (RF-RL) is to reduce the uncertainty in the estimated model with minimum number of trajectories, in practice, the agent often needs to abide by certain safety constraint at the same time. It remains unclear how such safe exploration requirement would affect the corresponding sample complexity to achieve the desired optimality of the obtained policy in planning. In this work, we make a first attempt to answer this question. In particular, we consider the scenario where a safe baseline policy is known beforehand, and propose a unified Safe reWard-frEe ExploraTion (SWEET) framework. We then particularize the SWEET framework to the tabular and the low-rank MDP settings, and develop algorithms coined Tabular-SWEET and Low-rank-SWEET, respectively. Both algorithms leverage the concavity and continuity of the newly introduced truncated value functions, and are guaranteed to achieve zero constraint violation during exploration with high probability. Furthermore, both algorithms can provably find a near-optimal policy subject to any constraint in the planning phase. Remarkably, the sample complexities under both algorithms match or even outperform the state of the art in their constraint-free counterparts up to some constant factors, proving that safety constraint hardly increases the sample complexity for RF-RL.

The generalization of machine learning models has a complex dependence on the data, model and learning algorithm. We study train and test performance, as well as the generalization gap given by the mean of their difference over different data set samples to understand their ``typical" behavior. We derive an expression for the gap as a function of the covariance between the model parameter distribution and the train loss, and another expression for the average test performance, showing test generalization only depends on data-averaged parameter distribution and the data-averaged loss. We show that for a large class of model parameter distributions a modified generalization gap is always non-negative. By specializing further to parameter distributions produced by stochastic gradient descent (SGD), along with a few approximations and modeling considerations, we are able to predict some aspects about how the generalization gap and model train and test performance vary as a function of SGD noise. We evaluate these predictions empirically on the Cifar10 classification task based on a ResNet architecture.

Statistical model checking is a class of sequential algorithms that can verify specifications of interest on an ensemble of cyber-physical systems (e.g., whether 99% of cars from a batch meet a requirement on their energy efficiency). These algorithms infer the probability that given specifications are satisfied by the systems with provable statistical guarantees by drawing sufficient numbers of independent and identically distributed samples. During the process of statistical model checking, the values of the samples (e.g., a user's car energy efficiency) may be inferred by intruders, causing privacy concerns in consumer-level applications (e.g., automobiles and medical devices). This paper addresses the privacy of statistical model checking algorithms from the point of view of differential privacy. These algorithms are sequential, drawing samples until a condition on their values is met. We show that revealing the number of the samples drawn can violate privacy. We also show that the standard exponential mechanism that randomizes the output of an algorithm to achieve differential privacy fails to do so in the context of sequential algorithms. Instead, we relax the conservative requirement in differential privacy that the sensitivity of the output of the algorithm should be bounded to any perturbation for any data set. We propose a new notion of differential privacy which we call expected differential privacy. Then, we propose a novel expected sensitivity analysis for the sequential algorithm and proposed a corresponding exponential mechanism that randomizes the termination time to achieve the expected differential privacy. We apply the proposed mechanism to statistical model checking algorithms to preserve the privacy of the samples they draw. The utility of the proposed algorithm is demonstrated in a case study.

The implicit stochastic gradient descent (ISGD), a proximal version of SGD, is gaining interest in the literature due to its stability over (explicit) SGD. In this paper, we conduct an in-depth analysis of the two modes of ISGD for smooth convex functions, namely proximal Robbins-Monro (proxRM) and proximal Poylak-Ruppert (proxPR) procedures, for their use in statistical inference on model parameters. Specifically, we derive non-asymptotic point estimation error bounds of both proxRM and proxPR iterates and their limiting distributions, and propose on-line estimators of their asymptotic covariance matrices that require only a single run of ISGD. The latter estimators are used to construct valid confidence intervals for the model parameters. Our analysis is free of the generalized linear model assumption that has limited the preceding analyses, and employs feasible procedures. Our on-line covariance matrix estimators appear to be the first of this kind in the ISGD literature.

Meta learning has demonstrated tremendous success in few-shot learning with limited supervised data. In those settings, the meta model is usually overparameterized. While the conventional statistical learning theory suggests that overparameterized models tend to overfit, empirical evidence reveals that overparameterized meta learning methods still work well -- a phenomenon often called ``benign overfitting.'' To understand this phenomenon, we focus on the meta learning settings with a challenging nested structure that we term the nested meta learning, and analyze its generalization performance under an overparameterized meta learning model. While our analysis uses the relatively tractable linear models, our theory contributes to understanding the delicate interplay among data heterogeneity, model adaptation and benign overfitting in nested meta learning tasks. We corroborate our theoretical claims through numerical simulations.

This paper studies the algorithmic stability and generalizability of decentralized stochastic gradient descent (D-SGD). We prove that the consensus model learned by D-SGD is $\mathcal{O}{(m/N+1/m+\lambda^2)}$-stable in expectation in the non-convex non-smooth setting, where $N$ is the total sample size of the whole system, $m$ is the worker number, and $1-\lambda$ is the spectral gap that measures the connectivity of the communication topology. These results then deliver an $\mathcal{O}{(1/N+{({(m^{-1}\lambda^2)}^{\frac{\alpha}{2}}+ m^{-\alpha})}/{N^{1-\frac{\alpha}{2}}})}$ in-average generalization bound, which is non-vacuous even when $\lambda$ is closed to $1$, in contrast to vacuous as suggested by existing literature on the projected version of D-SGD. Our theory indicates that the generalizability of D-SGD has a positive correlation with the spectral gap, and can explain why consensus control in initial training phase can ensure better generalization. Experiments of VGG-11 and ResNet-18 on CIFAR-10, CIFAR-100 and Tiny-ImageNet justify our theory. To our best knowledge, this is the first work on the topology-aware generalization of vanilla D-SGD. Code is available at https://github.com/Raiden-Zhu/Generalization-of-DSGD.  ( 2 min )

The recent emergence of reinforcement learning has created a demand for robust statistical inference methods for the parameter estimates computed using these algorithms. Existing methods for statistical inference in online learning are restricted to settings involving independently sampled observations, while existing statistical inference methods in reinforcement learning (RL) are limited to the batch setting. The online bootstrap is a flexible and efficient approach for statistical inference in linear stochastic approximation algorithms, but its efficacy in settings involving Markov noise, such as RL, has yet to be explored. In this paper, we study the use of the online bootstrap method for statistical inference in RL. In particular, we focus on the temporal difference (TD) learning and Gradient TD (GTD) learning algorithms, which are themselves special instances of linear stochastic approximation under Markov noise. The method is shown to be distributionally consistent for statistical inference in policy evaluation, and numerical experiments are included to demonstrate the effectiveness of this algorithm at statistical inference tasks across a range of real RL environments.  ( 3 min )

This work provides test error bounds for iterative fixed point methods on linear predictors -- specifically, stochastic and batch mirror descent (MD), and stochastic temporal difference learning (TD) -- with two core contributions: (a) a single proof technique which gives high probability guarantees despite the absence of projections, regularization, or any equivalents, even when optima have large or infinite norm, for quadratically-bounded losses (e.g., providing unified treatment of squared and logistic losses); (b) locally-adapted rates which depend not on global problem structure (such as condition numbers and maximum margins), but rather on properties of low norm predictors which may suffer some small excess test error. The proof technique is an elementary and versatile coupling argument, and is demonstrated here in the following settings: stochastic MD under realizability; stochastic MD for general Markov data; batch MD for general IID data; stochastic MD on heavy-tailed data (still without projections); stochastic TD on Markov chains (all prior stochastic TD bounds are in expectation).  ( 2 min )

The task of ranking individuals or teams, based on a set of comparisons between pairs, arises in various contexts, including sporting competitions and the analysis of dominance hierarchies among animals and humans. Given data on which competitors beat which others, the challenge is to rank the competitors from best to worst. Here we study the problem of computing rankings when there are multiple, potentially conflicting modes of comparison, such as multiple types of dominance behaviors among animals. We assume that we do not know a priori what information each behavior conveys about the ranking, or even whether they convey any information at all. Nonetheless we show that it is possible to compute a ranking in this situation and present a fast method for doing so, based on a combination of an expectation-maximization algorithm and a modified Bradley-Terry model. We give a selection of example applications to both animal and human competition.  ( 2 min )

Though learning has become a core component of modern information processing, there is now ample evidence that it can lead to biased, unsafe, and prejudiced systems. The need to impose requirements on learning is therefore paramount, especially as it reaches critical applications in social, industrial, and medical domains. However, the non-convexity of most modern statistical problems is only exacerbated by the introduction of constraints. Whereas good unconstrained solutions can often be learned using empirical risk minimization, even obtaining a model that satisfies statistical constraints can be challenging. All the more so, a good one. In this paper, we overcome this issue by learning in the empirical dual domain, where constrained statistical learning problems become unconstrained and deterministic. We analyze the generalization properties of this approach by bounding the empirical duality gap -- i.e., the difference between our approximate, tractable solution and the solution of the original (non-convex) statistical problem -- and provide a practical constrained learning algorithm. These results establish a constrained counterpart to classical learning theory, enabling the explicit use of constraints in learning. We illustrate this theory and algorithm in rate-constrained learning applications arising in fairness and adversarial robustness.  ( 3 min )

Dimensionality reduction (DR) plays a vital role in the visual analysis of high-dimensional data. One main aim of DR is to reveal hidden patterns that lie on intrinsic low-dimensional manifolds. However, DR often overlooks important patterns when the manifolds are strongly distorted or hidden by certain influential data attributes. This paper presents a feature learning framework, FEALM, designed to generate an optimized set of data projections for nonlinear DR in order to capture important patterns in the hidden manifolds. These projections produce maximally different nearest-neighbor graphs so that resultant DR outcomes are significantly different. To achieve such a capability, we design an optimization algorithm as well as introduce a new graph dissimilarity measure, called neighbor-shape dissimilarity. Additionally, we develop interactive visualizations to assist comparison of obtained DR results and interpretation of each DR result. We demonstrate FEALM's effectiveness through experiments using synthetic datasets and multiple case studies on real-world datasets.  ( 2 min )

Software packages like TensorFlow and PyTorch are designed to support linear algebra operations, and their speed and usability determine their success. However, by prioritising speed, they often neglect memory requirements. As a consequence, the implementations of memory-intensive algorithms that are convenient in terms of software design can often not be run for large problems due to memory overflows. Memory-efficient solutions require complex programming approaches with significant logic outside the computational framework. This impairs the adoption and use of such algorithms. To address this, we developed an XLA compiler extension that adjusts the computational data-flow representation of an algorithm according to a user-specified memory limit. We show that k-nearest neighbour and sparse Gaussian process regression methods can be run at a much larger scale on a single device, where standard implementations would have failed. Our approach leads to better use of hardware resources. We believe that further focus on removing memory constraints at a compiler level will widen the range of machine learning methods that can be developed in the future.  ( 2 min )

The paper introduces a method to construct confidence bands for bounded, band-limited functions based on a finite sample of input-output pairs. The approach is distribution-free w.r.t. the observation noises and only the knowledge of the input distribution is assumed. It is nonparametric, that is, it does not require a parametric model of the regression function and the regions have non-asymptotic guarantees. The algorithm is based on the theory of Paley-Wiener reproducing kernel Hilbert spaces. The paper first studies the fully observable variant, when there are no noises on the observations and only the inputs are random; then it generalizes the ideas to the noisy case using gradient-perturbation methods. Finally, numerical experiments demonstrating both cases are presented.  ( 2 min )

The electron density of a molecule or material has recently received major attention as a target quantity of machine-learning models. A natural choice to construct a model that yields transferable and linear-scaling predictions is to represent the scalar field using a multi-centered atomic basis analogous to that routinely used in density fitting approximations. However, the non-orthogonality of the basis poses challenges for the learning exercise, as it requires accounting for all the atomic density components at once. We devise a gradient-based approach to directly minimize the loss function of the regression problem in an optimized and highly sparse feature space. In so doing, we overcome the limitations associated with adopting an atom-centered model to learn the electron density over arbitrarily complex datasets, obtaining extremely accurate predictions. The enhanced framework is tested on 32-molecule periodic cells of liquid water, presenting enough complexity to require an optimal balance between accuracy and computational efficiency. We show that starting from the predicted density a single Kohn-Sham diagonalization step can be performed to access total energy components that carry an error of just 0.1 meV/atom with respect to the reference density functional calculations. Finally, we test our method on the highly heterogeneous QM9 benchmark dataset, showing that a small fraction of the training data is enough to derive ground-state total energies within chemical accuracy.  ( 3 min )

Good initialization is essential for training Deep Neural Networks (DNNs). Oftentimes such initialization is found through a trial and error approach, which has to be applied anew every time an architecture is substantially modified, or inherited from smaller size networks leading to sub-optimal initialization. In this work we introduce a new and cheap algorithm, that allows one to find a good initialization automatically, for general feed-forward DNNs. The algorithm utilizes the Jacobian between adjacent network blocks to tune the network hyperparameters to criticality. We solve the dynamics of the algorithm for fully connected networks with ReLU and derive conditions for its convergence. We then extend the discussion to more general architectures with BatchNorm and residual connections. Finally, we apply our method to ResMLP and VGG architectures, where the automatic one-shot initialization found by our method shows good performance on vision tasks.  ( 2 min )

Real-world applications of reinforcement learning for recommendation and experimentation faces a practical challenge: the relative reward of different bandit arms can evolve over the lifetime of the learning agent. To deal with these non-stationary cases, the agent must forget some historical knowledge, as it may no longer be relevant to minimise regret. We present a solution to handling non-stationarity that is suitable for deployment at scale, to provide business operators with automated adaptive optimisation. Our solution aims to provide interpretable learning that can be trusted by humans, whilst responding to non-stationarity to minimise regret. To this end, we develop an adaptive Bayesian learning agent that employs a novel form of dynamic memory. It enables interpretability through statistical hypothesis testing, by targeting a set point of statistical power when comparing rewards and adjusting its memory dynamically to achieve this power. By design, the agent is agnostic to different kinds of non-stationarity. Using numerical simulations, we compare its performance against an existing proposal and show that, under multiple non-stationary scenarios, our agent correctly adapts to real changes in the true rewards. In all bandit solutions, there is an explicit trade-off between learning and achieving maximal performance. Our solution sits on a different point on this trade-off when compared to another similarly robust approach: we prioritise interpretability, which relies on more learning, at the cost of some regret. We describe the architecture of a large-scale deployment of automatic optimisation-as-a-service where our agent achieves interpretability whilst adapting to changing circumstances.  ( 3 min )

Transformers are used for translation and text summarising tasks because they can analyze sequential input data, such as natural language. Transformers use the self-attention process and weights the importance of each component of the input data differently. Large-scale transformer-based language models have gained a lot of popularity recently in the disciplines of computer vision and natural language processing (NLP). They expand in size and complexity frequently, yet it costs millions of dollars, hires the greatest experts, and takes years to construct these models. Because of this, many companies have been unable to use it, and only significant IT organizations have access to this cutting-edge technology. To address these problems, Yandex has developed the largest YaLM model to date, which uses 100 billion parameters. This largest GPT-like neural network for English is currently available for free. The researchers used a pool of 800 A100 graphics cards, 1.7 TB of online materials, books, and countless other sources to train the model over the course of 65 days. They have published the model and relevant materials on GitHub under the Apache 2.0 license, allowing both academic and commercial use. Continue reading | Github submitted by /u/shobha-kakkar [link] [comments]  ( 84 min )

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I read a super interesting KDD 2022 paper recently - "Learning Backward Compatible Embeddings". The paper tackles a common industry problem of ensuring compatibility of newer embeddings with an older downstream model. An annotated version of the paper - Annotated-ML-Papers/Learning Backward Compatible Embeddings.pdf submitted by /u/shreyansh26 [link] [comments]  ( 82 min )

In recent years, image synthesis has experienced exponential growth in performance. The two main approaches to this task have been autoregressive transformers (ARs) and generative adversarial networks (GANs). The firsts are trained for sequence prediction and are able to generate images, token by token, starting from the first one. The seconds are based on the famous generator-discriminator method, where the generator tries to fool the discriminator into generating reliable samples. Nevertheless, both approaches have huge limitations: in particular, ARs require billions of parameters to be trained, while GANs rely on the minimax loss which has been demonstrated to often bring to mode collapse and instability in training. Diffusion models (DMs) have recently shown excellent results in different image synthesis tasks. They are based on two stages: in the first, noise is added to data step by step in a Markov chain modality, meaning that each step depends solely on the previous step. This process is repeated until losing the majority of the information of the original sample. Then, a denoising process is applied, aiming to reconstruct the image from the noisy version. Continue reading | Checkout the paper and github ​ https://i.redd.it/4w5te1twbe891.gif submitted by /u/shobha-kakkar [link] [comments]  ( 84 min )

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Hey there! I've been making games and programming to do that for around 8 years now. I have a pretty good know-how of most major programming languages, technologies, techniques in that realm by now but there's one thing that I've always struggled with: AI. Whenever I try to research it, I always seem to end up going down "buzz-word loopholes" as I like to call them, similar to a certain extent, to how if you try to research VR game dev now you might end up looking into the "metaverse" and stuff... I find lots of articles / youtube videos that explain either one very specific thing or they go too far abstract and explain how it works but not how to actually do it. What I'm really interested in is designing algorithms like Youtube's, Tiktok's or Google's, the ones that analyse large datasets and alter the platform depending on the results. I know quite a bit of this is machine learning now, but I actually want to gain a good understanding of how to write these algorithms and how to actually implement machine learning to make them, since I can think of many use cases where AI like this could be used in game development and other areas I'm interested in - Not to mention, this just sounds like a fun thing to learn! I'm happy to work with whatever languages and to learn new tools (of course!), but what I am really interested in is learning to create AI that analyses data specifically. All I've found so far when I wasn't just hitting those "buzz-word loopholes" was simple AI that can do things like solving sudoku or more complex ones like analysing images - But the issue is to a certain degree I already understand those sub-topics, and it isn't really the kind of AI I'm interested in learning about. ​ TLDR; So yeah, if anyone has any recommendations of recourses specifically targeted at AI that analyses data, or if I'm completely wrong and need to learn something else first, please chuck us a comment, it'd be much appreciated! submitted by /u/Ping-and-Pong [link] [comments]  ( 86 min )

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I am working on a midjourney based project to raise money for the AI for Good Foundation (ai4good.org). If anyone is interested in hearing more, please feel free to send me a dm. We are looking for volunteers in a few different areas: 1) (Extremely) part time experts in ML/AI/GANs to awnser people's questions 2) Artists to make AI/human collaboration art and post it in our "cyborg gallery" 3) People to make AI art using Midjourney (we have invites) and post them to Reddit etc. with a link to our Discord server. 4) (most important) people to handle prompt requests and generate/send people their results This project was given the green light by a team member at MJ, so they are fine with our charity project. Thanks for reaching, and once again, please reach out if you are interested! submitted by /u/Accomplished_Head5 [link] [comments]  ( 83 min )

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I've heard a lot that it's not just the tools that matter the most in the field of machine learning and MLOps, but mostly the design decisions one has to make in order to make stable models be pushed to production. And the design pattern varies from one organisation to another. While applying for a new job, how does an MLOps engineer showcase the most important design decisions they made in their past career? submitted by /u/metalvendetta [link] [comments]  ( 84 min )

I am currently working on a dataset for earnings of a specific market segment. For that I have created a dataset with the earnings as my dependent variable and multiple market parameters as my independent variables. For that I have accumulated data on weather, avg speed and so on for each month in 30 years, in total 80 different variables. Now I wanted to create a forecast with different time shifts (1 month, 2, 3, 4...) The goal is to have a forecast for market movement with data some x months prior. "How could earnings look next month with the knowledge of today". I used different regression methods, compared them and now have a model that can predict these values with an accuracy X. The results themselves arent bad, but not as good as I imagined. However, I think thats normal regardin…  ( 87 min )

YOLOv6 has been making a lot of noise in the past 24 hours. Based on its performance - rightfully so. YOLOv6 is a single-stage object detection framework dedicated to industrial applications, with hardware-friendly efficient design and high performance. It outperforms YOLOv5 in accuracy and inference speed, making it the best OS version of YOLO architecture for production applications. I dived into the technical details published by the research group and made a qualitative and qualitative comparison between the results of YOLOv5 and YOLOv6. I invite you to read about all of these, with a bit of history on YOLO, in the my new blog submitted by /u/RepresentativeCod613 [link] [comments]  ( 84 min )

How do pro-choice vs. pro-life twitter users differ? I built a free, labeled dataset of #RoeVsWade tweets, and an ML classifier on top. Some insights: Pro-life users are 20.4x more likely to put "christ" and 16.1x more likely to put "maga" in their bio.Pro-choice users are 7.5x more likely to put "blm" and 6.5x more likely to put "she/her". Full analysis + link to raw dataset here. submitted by /u/BB4evaTB12 [link] [comments]  ( 84 min )

PyTorch 1.12 Release Notes Highlights Backwards Incompatible Change New Features Improvements Performance Documentation Highlights We are excited to announce the release of PyTorch 1.12! This release is composed of over 3124 commits, 433 contributors. Along with 1.12, we are releasing beta versions of AWS S3 Integration, PyTorch Vision Models on Channels Last on CPU, Empowering PyTorch on Intel® Xeon® Scalable processors with Bfloat16 and FSDP API. We want to sincerely thank our dedicated community for your contributions. Summary: Functional Module API to functionally apply module computation with a given set of parameters Complex32 and Complex Convolutions in PyTorch DataPipes from TorchData fully backward compatible with DataLoader Functorch with improved coverage for APIs nvFuser a deep learning compiler for PyTorch Changes to float32 matrix multiplication precision on Ampere and later CUDA hardware TorchArrow, a new beta library for machine learning preprocessing over batch data https://github.com/pytorch/pytorch/releases/tag/v1.12.0 https://pytorch.org/blog/pytorch-1.12-released/ submitted by /u/DreamFlasher [link] [comments]  ( 85 min )

Hello! I am planning a research project which involves creating a classification DNN that takes in a frame from a molecular dynamics simulation of a protein which encodes each amino acid's level of energetic interaction and tries to predict whether that frame came from protein state "A" or protein state "B." I want to analyze the feature importance, that is, the importance of amino acid's energetic interaction level for making the classification prediction. Although I have heard some interesting applications with Shapley values to preform such an analysis on feature importance, the input layer structure of the model I am thinking of making would require 100+ neurons as there are 100+ features. The reason why the feature space is so large is because I am investigating how a model learns which amino acids are most important for the model to make a classification prediction for which state a protein is in where the protein is 100+ amino acids in length. Can Shapley methods handle a feature space of a model that large /would the computational cost of such a process be infeasible? Apologies if this question is a little unclear let me know if anything needs to be clarified. Thanks! submitted by /u/ben_cow [link] [comments]  ( 85 min )

I read a super interesting KDD 2022 paper recently - "Learning Backward Compatible Embeddings". The paper tackles a common industry problem of ensuring compatibility of newer embeddings with an older downstream model. An annotated version of the paper - Annotated-ML-Papers/Learning Backward Compatible Embeddings.pdf submitted by /u/shreyansh26 [link] [comments]  ( 84 min )

Hi everyone, I'm the creator of dstack, a tool that makes it easier to train models in the cloud. Our tool allows extending it with custom providers to support different languages, frameworks, etc. All the built-in providers are also open-source. Today, we've released a new update that extends the capabilities of dstack beyond training models, and now also allows users to quickly build and share apps with Streamlit, Gradio, and FastAPI in the cloud – in just a few clicks. Similar to apps, it's possible to run dev environments with required hardware and data access also in one command from the Terminal. All you have to do is to link your own AWS account to run commands. Invite everyone to read it, and share their thoughts. Happy to discuss the approach and what would be great to have! Blog post: https://blog.dstack.ai/introducing-apps-and-dev-environments P.S.: Currently, it's possible to run models and apps only in the configured cloud. If you'd like the tool to also allow you to run it locally, and if you would like this part to be open-source too, please leave comments! 🤗 submitted by /u/cheptsov [link] [comments]  ( 85 min )

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Abs: Probabilistic numerical computation formalises the connection between machine learning and applied mathematics. Numerical algorithms approximate intractable quantities from computable ones. They estimate integrals from evaluations of the integrand, or the path of a dynamical system described by differential equations from evaluations of the vector field. In other words, they infer a latent quantity from data. This book shows that it is thus formally possible to think of computational routines as learning machines, and to use the notion of Bayesian inference to build more flexible, efficient, or customised algorithms for computation. The text caters for Masters' and PhD students, as well as postgraduate researchers in artificial intelligence, computer science, statistics, and applied mathematics. Extensive background material is provided along with a wealth of figures, worked examples, and exercises (with solutions) to develop intuition. Link to book: https://www.probabilistic-numerics.org/textbooks/ submitted by /u/bikeskata [link] [comments]  ( 85 min )

Large language models and the recent spur of diffusion based text-to-image models are gosh-darn fun to play with, but due to their size and expensive training costs - they're only accessible via an API or if you yourself have a access to a large # of GPUs. Yet there are also a number of compression techniques like pruning and quantization that can drastically reduce the size (+90%), and thus computational requirements, of a trained model. Has there been any work looking appling such techniques to these gigantic models floating around to make them more accessible? submitted by /u/Farconion [link] [comments]  ( 86 min )

Transformers are awesome for so many things in 2022, but one thing I've found them to struggle with is generating embeddings for long documents. I put together a blog post going through some interesting techniques. Let me know if it helped you! Blog post submitted by /u/BlockDesigns [link] [comments]  ( 84 min )

Just released. Quaterion — an open source framework for training and fine-tuning similarity learning models. It enables you to train models significantly (100x) faster, and iterate over experiments in minutes instead of hours even with a laptop GPU. It takes advantage of the PyTorch Lightning backend to make a flexible and scalable learning pipeline. GitHub https://github.com/qdrant/quaterion Here is a demo of the caching functionality. https://i.redd.it/9qi8gf9n4d891.gif submitted by /u/devzaya [link] [comments]  ( 84 min )

Developers can use RestifyML to Create DataScience experiments Create Data Source and upload CSV data within the experiment Do Data Cleansing and Sanitization Visualize raw data using Data Exploration Select Features which would help in building models Build Model, save or export them Finally, deploy Model and expose them as REST API Consume Machine Learning REST API from any Application Profit! https://github.com/rebataur/RestifyML Feedback/ Feature Request appreciated. submitted by /u/rebataur [link] [comments]  ( 85 min )

Simple task: transformer has to repeat a sequence of random integers (0-9) of varied length, like: sequence length=7: input[ 1, 3 ,5 ,6, 2, 4, 0] - output[ 1, 3 ,5 ,6, 2, 4, 0] sequence length=3: input[ 5, 4 ,9 ] - output[ 5, 4 ,9 ] sequence length=4: input[ 6, 3 ,9, 8 ] - output[ 6, 3 ,9, 8 ] ... Each integer(0-9) can be stored in embedding layer so we can pass it to transformer. I trained transformer (generic pytorch model with positional embeddings) on a dataset (1000 examples) of sequences of varied length (1 to 12) and it predicts sequences well within the range of 12 . It fails to predict sequences longer than 12 - 13. sequence length=20: input[3, 3, 4, 0, 0, 7, 1, 5, 1, 0, 7, 1, 9, 0, 9, 1, 5, 2, 3, 6] .............................. ...- output[3, 3, 4, 0, 0, 7, 1, 5, 1, 0, 7, 1, 7, 1, 7, 1, 0, 7, 0, 7] Is it considered an extrapolation task? Are there types of transformers (or other neural networks) that can handle the problem ? Same issue with recurrent neural networks (RNN, LSTM, GRU). submitted by /u/InternationalVisito [link] [comments]  ( 89 min )

Pytorch 1.12 is available through the pytorch conda channel and pypi Release notes Issue tracker Highlights We are excited to announce the release of PyTorch 1.12! This release is composed of over 3124 commits, 433 contributors. Along with 1.12, we are releasing beta versions of AWS S3 Integration, PyTorch Vision Models on Channels Last on CPU, Empowering PyTorch on Intel® Xeon® Scalable processors with Bfloat16 and FSDP API. We want to sincerely thank our dedicated community for your contributions. Summary: Functional Module API to functionally apply module computation with a given set of parameters Complex32 and Complex Convolutions in PyTorch DataPipes from TorchData fully backward compatible with DataLoader Functorch with improved coverage for APIs nvFuser a deep learning compiler for PyTorch Changes to float32 matrix multiplication precision on Ampere and later CUDA hardware TorchArrow, a new beta library for machine learning preprocessing over batch data Other noteable changes CUDA 11.6 wheels torch.amp module submitted by /u/M4mb0 [link] [comments]  ( 85 min )

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Dear all, Welcome to join my continued ML knowledge dissemination class via Zoom. I will continue to explain machine learning using an intermediate level mathematics. It happens every second Thursday at GMT at 11:00 (HK7pm / SYD9pm) - the next class is on June 30. The current topic is: "Determinantal Point Process" I'll fully explain its beautiful mathematics over a period of a few sessions. This is a powerful model to model diverse subsets. Yet it is not as commonly used as it should! You can find my notes on my GitHub site: https://github.com/roboticcam/machine-learning-notes/ Determinantal Point Process notes is found at: https://github.com/roboticcam/machine-learning-notes/blob/master/files/dpp_new.pdf You need a solid understanding of linear algebra, calculus, probability and statistics. But if you just want to get a feel of how DPP works for example, and meet like-minded people, please come too! To join, sign up for one of the meetup groups you see fit: https://www.meetup.com/machine-learning-hong-kong/ https://www.meetup.com/deep-learning-sydney/ https://www.meetup.com/Deep-Learning-Melbourne/ https://www.meetup.com/machine-learning-athens/ submitted by /u/MLknowledge [link] [comments]  ( 85 min )

Two diffusion text-to-image generators are Google's Imagen and openai's DALLE.2. DALLE.2 uses a multimodal large language model called CLIP to encode an input text prompt. The output is produced by a reverse encoder called a diffusion probability model. Diffusion models have previously seen huge successes in image super resolution and denoising. One peculiar aspect of DALLE.2's output is that it is capable of generating light sources in certain (seemingly) 3D locations in the scene, then correctly lighting the objects based off of their implied location. DALLE.2 can also perform image completions from a starting image prompt. The two examples below are Spongebob dish sponge in a sink, and Vermeer's famous earring painting. https://i.imgur.com/vVI6IOI.png . https://i.imgur.com/8h48lTg.png . One plausible explanation for these physically perfect surface reflections is that DALLE.2 performs a phase where the image is reverse-encoded into a 3D scene. That scene is then rendered back into a 2D output image. However, when consulting the primary literature, no such conversion to a 3D model is seen anywhere along the DALLE.2 workflow. The implication is that DALLE.2 must contain a wealth of priors related to light transport, gleaned simply from 2D training images alone. This means these priors are being applied (mostly correctly) to particular instantiations of objects and surfaces in scenes. This application is performed even to the point where wet metallic surfaces have correct blurring in reflections. Further investigations of this phenomenon would involve finding some user prompts that generated a scene containing light casting a sharp shadow onto a flat surface. Another would be requesting a reflective object in the text prompt itself. Your thoughts? submitted by /u/moschles [link] [comments]  ( 87 min )

Jupyter Notebook: https://colab.research.google.com/drive/1BsVkddtVMX35aZAvo2GyI-wSFPVBCWuA Github: https://github.com/facebookresearch/torchdim Some tweet threads about it Mine: https://twitter.com/cHHillee/status/1541536627746426881 Sasha Rush: https://twitter.com/srush_nlp/status/1541526906113298433 submitted by /u/programmerChilli [link] [comments]  ( 84 min )

When evaluating the effectiveness of a new feature, it is common to train a model with/without this feature to compare the difference. But sometimes training a model based on huge amounts of data is both time and energy consuming. I was wondering if there are some lightweight ways to estimate the importance of the new feature without training? Computing descriptive statistics such as feature coverage, histogram and correlation matrix might be necessary, are there other pre-processing methods? submitted by /u/fishiwhj [link] [comments]  ( 84 min )

I just finished reading "Benchmarking Graph Neural Networks" (Dwivedi et al. 2020) and "A Generalization of Transformer Networks to Graphs" (also Dwivedi et al. 2020), and came across the claim that the eigenvectors of the Laplacian of a graph "represent a natural generalization of the Transformer (Vaswani et al., 2017) positional encodings (PE)". Xavier Bresson tweeted the same thing. So I worked out the eigenvectors of the Laplacian of a path graph (a line of vertices connected by edges like so: v-v-v-...-v), which is the kind of graph used in NLP to represent a sequence of tokens, and found that the ith eigenvector's kth entry is v_i(k) = cos(πik/n − πi/2n) where n is the number of tokens in the sequence, which is very different from the sinusoidal PEs used in transformers in NLP. I tried working out a change of variables, but nothing's worked so far. Are Laplacian eigenvectors just not the generalizations they're claimed to be, or am I missing something here? submitted by /u/hegelian_waffle [link] [comments]  ( 85 min )

The second AI Policy Forum Symposium convened global stakeholders across sectors to discuss critical policy questions in artificial intelligence.  ( 7 min )

Good day all, I have previously seen some Fitted Q iteration tutorials in a cart pole environment in which neural networks were used in updating Q values (e. https://github.com/seungjaeryanlee/implementations-nfq/tree/master/nfq). I am interested in doing something similar only, that I have to replace those neural network estimators with Gaussian processes. Please can anyone recommend some useful tutorials (Free/Paid) for using Gaussian processes for Cartpole setup? I have some but they are a little bit too theoretical with little/no practical/ programming. I will also appreciate links to some libraries or repos that provide more insights on the subject matter. submitted by /u/Thin-Ad9581 [link] [comments]  ( 83 min )

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Hey guys, I wrote my first blog post on RL about changing the reward function by a constant and how this can result in a different policy. At first thought this feels strange since the constant should not affect the expected sum of returns! Please let me know what you think. https://ea-aguilar.gitbook.io/rl-vault/food-for-thought/suicidal-agents Also, I'm not such a big fan of medium bc I want to keep the option to write more equations, but it seems it's the de-facto place to blog about ML/RL. Do you recommend also posting there? context: A couple of years ago I made a career switch into RL - and recently have been wanting to write more. So as an exercise, I want to start writing down some cute observations/thoughts about RL. I figure this could also help some people out there who are just now venturing into the field. submitted by /u/EdAlexAguilar [link] [comments]  ( 85 min )

Hello All. We have designed a set of continuous reinforcement learning environments with locomotion tasks in space. The goal is to navigate a (planar) spaceship to reach the prescribed goals, or enter a prescribed orbit. The tasks in general seems simple, but we were surprised that they pose a serious challenge for vanilla RL approaches. We learned a lot from the environment design process. We find it particularly challenging to appropriately shape the reward function such that the RL algorithm converges to a satisfactory control. We used stable-baselines3 implementations of SAC, TD3, PPO with default hiperparameters (tuned for MuJoCo) One set of environments is about reaching the consecutive goals (regenerated randomly). In case there are 2 planets, the SAC agent performs perfectly, and matches the human baseline score (we have a keyboard controlled agent) 4715 +- 799 ​ SAC & TD3 evaluation curves for 2 planet goal env ​ the best agent (SAC) for 2 planet goal env In case an additional planet is added, the SAC agent performs poorly , and its performance is far from the human baseline score 4659 +-747 ​ SAC & TD3 evaluation curves for 2 planet goal env ​ ​ the best agent (SAC) for 3 planet goal env In case of 4 planets the performance drops even further. We could not explain the dramatic performance drop when increasing the number of planets from 2 to more (3,4). AI seemingly could not learn here the principles of the gravitational force . Any ideas which RL algorithm would do better here ? We plan to take a look at Physic-Informed RL. In case you want to take a look the envs are published here https://github.com/MIMUW-RL/space-gym Best, Jacek submitted by /u/dzako1 [link] [comments]  ( 85 min )

We are working on developing a DQN approach to sequence actions. The actions can only be taken once. I have read in several threads that you can prevent illegal actions from being selected both during learning (taking the max value over only legal actions) and during actual policy implementation (same), and like this your policy stays always legal. But my question is: do you need to supply the list of "exhausted actions" as part of the state? How would the q network be able to know what value to expect, when the remaining actions are completely determined by the already taken actions, if they are not supplied as part of the state at the input of the network? I have not found a single reference where the need to input the exhausted actions as part of the state is described. Any help or guidance would be greatly appreciated. C submitted by /u/Fresh-Literature-623 [link] [comments]  ( 85 min )

Hey! I am very new to reinforcement learning and I am writing my bachelor thesis on a game where I have to use a learning method, however I don't really seem to understand how to solve it really. I hope the question is fine. I have to read a paper and implement it, then turn it into a repeated case and apply simple learning to it. The paper is about a pirate-farmer game where there are 3 islands. The farmer chooses an islands and plants flowers on it. The islands have different sizes, one holds 3 flowers, one holds 4 and the last 8. If the pirate chooses the same island as the farmer he gets the flowers, otherwise the farmer keeps them. This game is then played multiple rounds and the paper basically talks about the nash equilibrium of both players to choose each island. I have talked to my tutor about it and she told me to try and apply q-learning to it, however I don't exactly understand how to do that. When I read about q-learning and watched videos about it, people used it for a treasure hunt mostly to find the shortest path from one location to another. However I don't understand how to make the game repeated without changing the game itself, if that makes sense? Sorry if the question doesn't make a lot of sense, like I said I am still pretty new at it. submitted by /u/False-Bluebird-3538 [link] [comments]  ( 85 min )

Amazon Polly is a leading cloud-based service that converts text into lifelike speech. Following the adoption of Neural Text-to-Speech (NTTS), we have continuously expanded our portfolio of available voices in order to provide a wide selection of distinct speakers in supported languages. Today, we are pleased to announce four new additions: Pedro speaking US Spanish, […]  ( 5 min )

Amazon SageMaker provides a suite of built-in algorithms, pre-trained models, and pre-built solution templates to help data scientists and machine learning (ML) practitioners get started on training and deploying ML models quickly. You can use these algorithms and models for both supervised and unsupervised learning. They can process various types of input data, including tabular, […]  ( 7 min )

In computer vision, semantic segmentation is the task of classifying every pixel in an image with a class from a known set of labels such that pixels with the same label share certain characteristics. It generates a segmentation mask of the input images. For example, the following images show a segmentation mask of the cat […]  ( 9 min )

Every business needs the ability to predict the future accurately in order to make better decisions and give the company a competitive advantage. With historical data, businesses can understand trends, make predictions of what might happen and when, and incorporate that information into their future plans, from product demand to inventory planning and staffing. If […]  ( 10 min )

In order to share the magic of DALL·E 2 with a broad audience, we needed to reduce the risks associated with powerful image generation models. To this end, we put various guardrails in place to prevent generated images from violating our content policy. This post focuses on pre-training  ( 13 min )

Enterprises now have a new option for quickly getting started with NVIDIA AI software: the HPE GreenLake edge-to-cloud platform. The NVIDIA AI Enterprise software suite is an end-to-end, cloud-native suite of AI and data analytics software. It’s optimized to enable any organization to use AI, and doesn’t require deep AI expertise. Fully supported by NVIDIA, Read article > The post NVIDIA Teams With HPE to Take AI From Edge to Cloud appeared first on NVIDIA Blog.  ( 5 min )

Taiwan has nearly 85,000 kidney dialysis patients — the highest prevalence in the world based on population density. Taipei Veterans General Hospital (TVGH) is working to improve outcomes for these patients with an AI model that predicts heart failure risk in real time during dialysis procedures. Cardiovascular disease is the leading cause of death for Read article > The post Detect to Protect: Taiwan Hospital Deploys Real-Time AI Risk Prediction for Kidney Patients appeared first on NVIDIA Blog.  ( 7 min )

Does any one know any good books or tutorials on time series classification using recurrent neural networks (LSTM)? Currently working on an EHR dataset and need to classify/predict disease, I know I can use normal classifiers i.e. SVM or XGboost but wanted to avoid the feature engineering that comes with this and thought neural networks would be the way to go. Just need good guidance on how to go about implementing it via a book or tutorial. Much appreciated submitted by /u/Abeokuta_ [link] [comments]  ( 84 min )

For a simple TF2 Object detection CNN architecture defined using Keras's functional API, a batch of data is obtained as: example, label = next(data_generator(batch_size = 32)) example.keys() # dict_keys(['image']) image = example['image'] image.shape # (32, 144, 144, 3) label.keys() # dict_keys(['class_out', 'box_out']) label['class_out'].shape, label['box_out'].shape # ((32, 9), (32, 2)) The CNN architecture defined using Keras's functional API is: input_ = Input(shape = (144, 144, 3), name = 'image') # name - An optional name string for the Input layer. Should be unique in # a model (do not reuse the same name twice). It will be autogenerated if it isn't provided. # Here 'image' is the Python3 dict's key used to map the data to one of the layer in the model. x = input_ # Define a c…  ( 85 min )

Moderation is the process of controlling the wanted contents from the online platforms like social media networking sites. And it is…  ( 8 min )

“Homer Simpson reacting to the crash of Bitcoin” Continue reading on Becoming Human: Artificial Intelligence Magazine »  ( 10 min )

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Hi, I currently work in the auto industry, and have recently solidified an opportunity to transfer from my current role in Manufacturing to a role within AI, specifically focusing on Autonomous Driving. I currently work as a data scientist, and am responsible for setting up pipelines, modeling, forecasting, etc.. I am fluent in Python and have some basic introductory experience in Neural Nets and using image tensors (a capstone project in undergrad, graduate school). I currently make 70k but would like to obviously aim higher, given the current market and skills required for this job. I have 3.5 years of experience when looking at my career from a general "computer science" point of view. What is a reasonable amount to expect in a position like this? Should I throw out a large number and work backwards with my company from there? The position is Remote, but based out of MI, USA. I live in the States. Thanks. submitted by /u/Mr15ization [link] [comments]  ( 84 min )

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Hey All, Just wanted to throw a quick remind that Device42 is hosting an upcoming AI webinar with award winning author Steve Shwartz (Evil Robots, Killer Computers, and Other Myths) and our CMO Yama Habibzai tomorrow, June 28th at 11 AM EDT as they discuss the impact of AI in IT and how you can leverage it to achieve more. Save your seat today Cheers. submitted by /u/Device42_Phil [link] [comments]  ( 83 min )

View the tutorial here: HERE This tutorial teaches you how to convert any text prompt to an image using VQGAN-Clip. For example you could use the prompt "A spray painting of a waiting computer and a bedroom in the style of Edgar Degas and Art Nouveau". This would generate the following image: https://imgur.com/J3qGlc4 Let me know if you have any questions or comments. submitted by /u/mshriver2 [link] [comments]  ( 83 min )

Hi all Hope everyone is having a good Monday (Tuesday depending on where you are). I have an undergraduate degree in Economics. I have spent a few years working now (mainly in economic analysis), but I am looking at doing an MSc in the DS/ML/AI space as I think it could help my current job, but equally, I have a genuine interest in the fields so could utilise it for a career switch. The two courses I am looking at are: https://online.essex.ac.uk/courses/msc-data-science/#overview https://online.essex.ac.uk/courses/msc-artificial-intelligence/ I am unsure whether it is better to go a bit more general and opt for the DS course, or go for the AI course. Personally, some of the DS modules I feel I already have the skills in such as the data visualisation, which is pushing me towards AI. Furthermore, when I have done some basic NLP, I have enjoyed that a lot and that's available in the AI course but not the DS course (you can see in the course structure then module choice what is included). In terms of future career, as I said above potential career switch (even if it means I have to go into an entry level job before climbing up the ladder again). A PhD would also be an option. Do you have any advice or general thoughts on the two courses above? Cheers all submitted by /u/chickenparmo [link] [comments]  ( 85 min )

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Hello everyone, I have recently soft-launched a Mac app called Elephas that lets you write faster across applications on your Mac. It was even trending on HackerNews for a few hours. See the GIFs attached to see how it works. ​ Email ​ https://i.redd.it/iv3y0gdqm5891.gif It uses your own OpenAI keys and works almost across all applications like Mail, Message, Pages, Google Docs, and Gmail/Outlook. It also has features for, Sentence rewriting (such as professional and friendly modes) Fixing grammar mistakes Translation support I hope you will find it helpful. Feel free to share your feedback :) submitted by /u/juliarmg [link] [comments]  ( 83 min )

How would one go upon building a "real-life" Jarvis? I am interested in learning and attempting to build an AI. I may sound and be very stupid of me but, I would like to learn to build something that can do everything on its own. Would it be possible for me to build an AI that I could teach like I would if I had a child? I have like all these ideas in my head of making AI that could do anything and starts off as a child and you teach it and teach it until it is what you want it to be. Where would I even really start from, is it even possible for me to do something like these? submitted by /u/ITZSELLABGAMING [link] [comments]  ( 84 min )

I've wanted to learn Data Science/AI for a long time now. My question is: is it better a bootcamp or a master for learning? In case a bootcamp was better, is there anyone you could recommend? Thanks in advance :) submitted by /u/ale3x_ [link] [comments]  ( 82 min )

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If possible, the AI should remove all non-factual things from the cookbooks/non-fiction books to create a short text that is full of content and does not contain useless words or private stories to make the book more expensive. submitted by /u/xXLisa28Xx [link] [comments]  ( 82 min )

And now one of artificial intelligence’s greatest strengths is that it can solve things, arriving at a valid answer, and we have no idea how it did it. It’s called efficient when AI does it! submitted by /u/shawster [link] [comments]  ( 83 min )

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With a potential recession lurking on the horizon, 99% of companies will make the same old “safe” mistakes: hunker down, let people go, shrink, and hope to hold on for dear life. However, growth-oriented organizations will see this as a business opportunity – an opportunity to leverage their data to “do more with less”.  You… Read More »Data & Analytics Regression Playbook: Make Your Data Work Harder…And Smarter! The post Data & Analytics Regression Playbook: Make Your Data Work Harder…And Smarter! appeared first on Data Science Central.  ( 22 min )

Hello everyone, my goal is to do research in the field of machine learning for motion planning/robotics in general. I'm really interested in the theoretical/mathematical side of the field. However I noticed that the majority of the field consists of very experimental papers where architectures are built and bench-marked without any thorough underlying theory. So my questions is: Are there any theoretical research areas in machine learning for motion planning/robotics in general? It would be nice if someone could also give me some labs/researchers working in that direction. ​ Thank you very much. submitted by /u/-aplusib- [link] [comments]  ( 84 min )

submitted by /u/s7v7nsilver [link] [comments]  ( 84 min )

I'm interested in studying properties of particular protein domains. One idea is to take advantage of state-of-the-art protein embedding models, such as this, most of which are based on transformers. Some of the domains I'm studying are found in large proteins, which have multiple other domains in the same chain. Therefore, I believe it might be more informative to obtain embeddings not of each protein as a whole, but just the domains. However, I worry that the embeddings would be all off, since the model expects a complete sequence. Has anyone tried this before? Are the pre-trained domain-level embeddings? submitted by /u/OmOshIroIdEs [link] [comments]  ( 84 min )

We're used to finding that task performance scales well with large increases in sizes of language models. But for real-world applications, it's also very meaningful to search for failure cases preemptively to fix the underlying issues. Can you find and convincingly demonstrate these failure cases where language models scale inversely, with larger models behaving worse? You don't necessarily need to have extra deep knowledge of ML or language models in order to participate and win, because all models are frozen and you only need to come up with the right data. Check out these resources to learn more! Announcement Twitter thread, contest details on Github. The deadline for the first round of the contest is August 27, 2022. submitted by /u/alexlyzhov [link] [comments]  ( 87 min )

Surprised I haven't seen more chatter about this. What do you think about Nvidia's instant Nerf which turns 2d into 3d based on these techniques https://arxiv.org/abs/2003.10016 Does the output of a NeRF give a depth map that's comparable to what you'd get from a Kinect? Can these be used to create 3D models one would use in Unreal or Blender? submitted by /u/KalloDotIO [link] [comments]  ( 84 min )

We're currently doing research on computational social science, specifically on online toxicity. We have lots of text data, but we don't have annotations. As part of the research, we are thinking of annotating the text using a crowd-sourcing approach. Do any of you know of any open-source tool that we could employ to ease up the process? submitted by /u/vigneshwaranpersonal [link] [comments]  ( 84 min )

Hey r/MachineLearning! We are the co-founders of Stack, a hub for data collaboration and versioning. We are developing this tool to help ML teams automatically track changes in their data seamlessly. We are opening a waiting list for our beta, which we aim to release soon. You can sign up at: https://www.getstack.ai/ We are also actively looking for feedback. Feel free to share any comments or thoughts! submitted by /u/baceituno [link] [comments]  ( 84 min )

The deployment of ML models in production is a delicate process filled with challenges. You can deploy a model via a REST API, on an edge device, or as as an off-line unit used for batch processing. You can build the deployment pipeline from scratch, or use ML deployment frameworks. In my new mini-series, you'll learn best practices to deploy your ML models. I try to concentrate everything in 2 videos, to keep the series short and sweet. The first video provides a theoretical overview of ML deployment. You'll learn about: Different strategies to deploy ML in production. The main ML deployment tools on the market (TF Serving, MLFlow Model, Seldon Deploy, KServe from Kubeflow). BentoML and its features. Here's the video: https://www.youtube.com/watch?v=Mrv3CZNWYEg submitted by /u/diabulusInMusica [link] [comments]  ( 85 min )

I am trying to train a latent-diffusion model by following the instructions on the repo, however I am running into errors while sampling from the checkpointed models. Can someone help? I am getting Errors while trying to sample using sample_diffusion.py from a custom model trained on LSUN churches submitted by /u/icelebratefestivus [link] [comments]  ( 85 min )

I am Xianbiao Qi, a computer vision researcher with more than ten years of research experience. I am writing this blog to complain of a serious case of deliberate plagiarism of our paper by the employees from IBM Zurich Research. They did not copy texts, they copied the idea. Our preprint paper on Arxiv is "Jiaquan Ye, Xianbiao Qi, Yelin He, and etc."PingAn-VCGroup's Solution for ICDAR 2021 Competition on Scientific Literature Parsing Task B: Table Recognition to HTML." arXiv preprint arXiv:2105.01848, May 2021" and the code was also released. Our paper (Ye et al. arXiv: 2105.01848) was plagiarised by a team in IBM Zurich Research: "Ahmed Nassar, Nikolaos Livathinos, Maksym Lysak, and Peter Staar, "TableFormer: Table Structure Understanding with Transformers." In Proceedings of the IE…  ( 97 min )

Suppose I have a data set consisting of weighted undirected simple graphs. I would like to learn a vector representation of these graphs. What are the state-of-the-art (2022) architectures/methods for learning such representations? Ideally, the representations are permutation-invariant. For what it's worth, I am only interested in the case where graphs (vertices, edges, and their respective weights) are fully observed; I'm not interested cases unobserved nodes. An additional requirement is the embedding must have a lower dimension that the number of nodes. submitted by /u/heylibrarian [link] [comments]  ( 87 min )

I'm looking for papers which use the skipgram model but instead of a lookup table they use a neural network. The use case is instead of sentences of words I want to use sequences of human behavior where additional information is available, e.g. think sequences of visited Amazon products. Cold-start also happens to be very common and I'm thinking that using a neural network instead of lookup embeddings table would be better. Updated with more context: The typical usage of skip gram is for learning word embedding as in text where each word has an embedding which is learned through skipgram. However there is nothing limiting the usage of skipgram for non-text cases. A popular way to use skipgram in i2i recommendation systems is to treat a session of products browsed by the user as a sequence and to have an embedding per product. (Eg see KDD 2018 winning paper from Airbnb) However, the question I have here is instead of having one embedding per product can we instead use a neural network where the output layer is the embedding layer. This way we can backprop through the neural network. The reason is we have more information for products than we do for words submitted by /u/curiousML5 [link] [comments]  ( 86 min )

I've been looking into using the Perciever for a project that involves single-channel (mono) audio. From the existing implementations and tutorials, I can't find one that only does audio. It seems like in the papers they rearrange the audio into patches and add position encodings, but this is a hack to bring the audio modality into the same size tensor as other modalities. If only using 1d audio is there any need at all for position encodings at all? submitted by /u/WigglyHypersurface [link] [comments]  ( 84 min )

We usually use TensorFlow to build a neural network. However, TensorFlow is not limited to this. Behind the scene, TensorFlow is a tensor library with automatic differentiation capability. Hence we can easily use it to solve a numerical optimization problem with gradient descent. In this post, we are going to show how TensorFlow’s automatic differentiation […] The post Using autograd in TensorFlow to Solve a Regression Problem appeared first on Machine Learning Mastery.  ( 16 min )

An introduction to machine learning algorithms  ( 8 min )

View the tutorial here: HERE This tutorial teaches you how to convert any text prompt to an image using VQGAN-Clip. For example you could use the prompt "A spray painting of a waiting computer and a bedroom in the style of Edgar Degas and Art Nouveau". This would generate the following image: https://imgur.com/J3qGlc4 Let me know if you have any questions or comments. submitted by /u/mshriver2 [link] [comments]  ( 83 min )

Object localization trained from scratch for emoji dataset in TensorFlow 2.8. Getting an IoU = 0.5969 and classification output accuracy = 100%. The code can be referred here. Though in fairness, I am using only 9 classes out of the emoji dataset. Thoughts? submitted by /u/grid_world [link] [comments]  ( 82 min )

submitted by /u/Plazmeer [link] [comments]  ( 82 min )

As some people liked the idea, let's read this together! :) ​ As mentioned in the previous post, the plan is to read one chapter per week-new chapters on mondays-,so it will be a 17 week endeavour. For those who don't know: the latest version of the book can be found here for free: http://incompleteideas.net/book/the-book-2nd.html. Code, Errata and other materials can be found as well. ​ The first week starts off mildly with the introduction chapter with only 13 pages. It may be worthwhile to use that week to think about how you want to read the book (Noteworthy book summary on reading well: https://en.wikipedia.org/wiki/How_to_Read_a_Book) and what you want to do with what you read. Personally, I'm planning to focus on getting the facts written down as anki flashcards (I can make them available online if people are interested) and following the math and algorithms by hand, so I'll get a notebook with lots of space for errors... Also some people asked for a Discord server to connect with others, but I personally have no idea how to moderate a discord server. Dexdev08 was so kind to recommend the RL Group Discord Server (https://discord.gg/RGsYwkJY) and asked there if we could get a channel for our cause (no answer on that yet, though). I hope that satisfies the need for a Discord server. ​ Happy Reading, I hope for some lively discussions. :) submitted by /u/Accomplished-Ninja31 [link] [comments]  ( 84 min )

Also i am getting confused, how does the equality hold here? https://preview.redd.it/jd3m2plza6891.png?width=820&format=png&auto=webp&s=55a3900aa9bd1e50dff31673d0150f6c14acd030 submitted by /u/aabra__ka__daabra [link] [comments]  ( 85 min )

I'm going to reread the book from start to finish again, maybe some people want to join? I will go for one chapter per week. If people want to join and discuss (and perhaps share notes?), I'd create a new post dedicated to that end every monday. What do you think? ​ Edit: Here we go! submitted by /u/Accomplished-Ninja31 [link] [comments]  ( 84 min )

submitted by /u/disdisinform [link] [comments]  ( 85 min )

Launched at AWS re:Invent 2021, Amazon SageMaker Ground Truth Plus helps you create high-quality training datasets by removing the undifferentiated heavy lifting associated with building data labeling applications and managing the labeling workforce. All you do is share data along with labeling requirements, and Ground Truth Plus sets up and manages your data labeling workflow […]  ( 6 min )

A couple years ago I wrote about how NASA was interested in regions bounded by curves of the form For example, here’s a plot for A = 2, B = 1, α = 2.5 and β = 6. That post mentioned a technical report from NASA that explains why these shapes are important in application, […] NASA and conformal maps first appeared on John D. Cook.  ( 6 min )

An ongoing trend in generative modelling research has been to push sample resolutions higher whilst simultaneously reducing computational requirements for training and sampling. We aim to push this trend further via the combination of techniques - each component representing the current pinnacle of efficiency in their respective areas. These include vector-quantized GAN (VQ-GAN), a vector-quantization (VQ) model capable of high levels of lossy - but perceptually insignificant - compression; hourglass transformers, a highly scaleable self-attention model; and step-unrolled denoising autoencoders (SUNDAE), a non-autoregressive (NAR) text generative model. Unexpectedly, our method highlights weaknesses in the original formulation of hourglass transformers when applied to multidimensional data. In light of this, we propose modifications to the resampling mechanism, applicable in any task applying hierarchical transformers to multidimensional data. Additionally, we demonstrate the scalability of SUNDAE to long sequence lengths - four times longer than prior work. Our proposed framework scales to high-resolutions ($1024 \times 1024$) and trains quickly (2-4 days). Crucially, the trained model produces diverse and realistic megapixel samples in approximately 2 seconds on a consumer-grade GPU (GTX 1080Ti). In general, the framework is flexible: supporting an arbitrary number of sampling steps, sample-wise self-stopping, self-correction capabilities, conditional generation, and a NAR formulation that allows for arbitrary inpainting masks. We obtain FID scores of 10.56 on FFHQ256 - close to the original VQ-GAN in less than half the sampling steps - and 21.85 on FFHQ1024 in only 100 sampling steps.

It has been a recent trend to leverage the power of supervised learning (SL) towards more effective reinforcement learning (RL) methods. We propose a novel phasic approach by alternating online RL and offline SL for tackling sparse-reward goal-conditioned problems. In the online phase, we perform RL training and collect rollout data while in the offline phase, we perform SL on those successful trajectories from the dataset. To further improve sample efficiency, we adopt additional techniques in the online phase including task reduction to generate more feasible trajectories and a value-difference-based intrinsic reward to alleviate the sparse-reward issue. We call this overall algorithm, PhAsic self-Imitative Reduction (PAIR). PAIR substantially outperforms both non-phasic RL and phasic SL baselines on sparse-reward goal-conditioned robotic control problems, including a challenging stacking task. PAIR is the first RL method that learns to stack 6 cubes with only 0/1 success rewards from scratch.

Machine learning (ML) offers powerful methods for detecting and modeling associations often in data with large feature spaces and complex associations. Many useful tools/packages (e.g. scikit-learn) have been developed to make the various elements of data handling, processing, modeling, and interpretation accessible. However, it is not trivial for most investigators to assemble these elements into a rigorous, replicatable, unbiased, and effective data analysis pipeline. Automated machine learning (AutoML) seeks to address these issues by simplifying the process of ML analysis for all. Here, we introduce STREAMLINE, a simple, transparent, end-to-end AutoML pipeline designed as a framework to easily conduct rigorous ML modeling and analysis (limited initially to binary classification). STREAMLINE is specifically designed to compare performance between datasets, ML algorithms, and other AutoML tools. It is unique among other autoML tools by offering a fully transparent and consistent baseline of comparison using a carefully designed series of pipeline elements including: (1) exploratory analysis, (2) basic data cleaning, (3) cross validation partitioning, (4) data scaling and imputation, (5) filter-based feature importance estimation, (6) collective feature selection, (7) ML modeling with `Optuna' hyperparameter optimization across 15 established algorithms (including less well-known Genetic Programming and rule-based ML), (8) evaluation across 16 classification metrics, (9) model feature importance estimation, (10) statistical significance comparisons, and (11) automatically exporting all results, plots, a PDF summary report, and models that can be easily applied to replication data.

Learned recommender systems may inadvertently leak information about their training data, leading to privacy violations. We investigate privacy threats faced by recommender systems through the lens of membership inference. In such attacks, an adversary aims to infer whether a user's data is used to train the target recommender. To achieve this, previous work has used a shadow recommender to derive training data for the attack model, and then predicts the membership by calculating difference vectors between users' historical interactions and recommended items. State-of-the-art methods face two challenging problems: (1) training data for the attack model is biased due to the gap between shadow and target recommenders, and (2) hidden states in recommenders are not observational, resulting in inaccurate estimations of difference vectors. To address the above limitations, we propose a Debiasing Learning for Membership Inference Attacks against recommender systems (DL-MIA) framework that has four main components: (1) a difference vector generator, (2) a disentangled encoder, (3) a weight estimator, and (4) an attack model. To mitigate the gap between recommenders, a variational auto-encoder (VAE) based disentangled encoder is devised to identify recommender invariant and specific features. To reduce the estimation bias, we design a weight estimator, assigning a truth-level score for each difference vector to indicate estimation accuracy. We evaluate DL-MIA against both general recommenders and sequential recommenders on three real-world datasets. Experimental results show that DL-MIA effectively alleviates training and estimation biases simultaneously, and achieves state-of-the-art attack performance.

Data imbalance, in which a plurality of the data samples come from a small proportion of labels, poses a challenge in training deep neural networks. Unlike classification, in regression the labels are continuous, potentially boundless, and form a natural ordering. These distinct features of regression call for new techniques that leverage the additional information encoded in label-space relationships. This paper presents the RankSim (ranking similarity) regularizer for deep imbalanced regression, which encodes an inductive bias that samples that are closer in label space should also be closer in feature space. In contrast to recent distribution smoothing based approaches, RankSim captures both nearby and distant relationships: for a given data sample, RankSim encourages the sorted list of its neighbors in label space to match the sorted list of its neighbors in feature space. RankSim is complementary to conventional imbalanced learning techniques, including re-weighting, two-stage training, and distribution smoothing, and lifts the state-of-the-art performance on three imbalanced regression benchmarks: IMDB-WIKI-DIR, AgeDB-DIR, and STS-B-DIR.

Sequence clustering in a streaming environment is challenging because it is computationally expensive, and the sequences may evolve over time. K-medoids or Partitioning Around Medoids (PAM) is commonly used to cluster sequences since it supports alignment-based distances, and the k-centers being actual data items helps with cluster interpretability. However, offline k-medoids has no support for concept drift, while also being prohibitively expensive for clustering data streams. We therefore propose SECLEDS, a streaming variant of the k-medoids algorithm with constant memory footprint. SECLEDS has two unique properties: i) it uses multiple medoids per cluster, producing stable high-quality clusters, and ii) it handles concept drift using an intuitive Medoid Voting scheme for approximating cluster distances. Unlike existing adaptive algorithms that create new clusters for new concepts, SECLEDS follows a fundamentally different approach, where the clusters themselves evolve with an evolving stream. Using real and synthetic datasets, we empirically demonstrate that SECLEDS produces high-quality clusters regardless of drift, stream size, data dimensionality, and number of clusters. We compare against three popular stream and batch clustering algorithms. The state-of-the-art BanditPAM is used as an offline benchmark. SECLEDS achieves comparable F1 score to BanditPAM while reducing the number of required distance computations by 83.7%. Importantly, SECLEDS outperforms all baselines by 138.7% when the stream contains drift. We also cluster real network traffic, and provide evidence that SECLEDS can support network bandwidths of up to 1.08 Gbps while using the (expensive) dynamic time warping distance.

Traffic congestion is a serious problem in urban areas. Dynamic congestion pricing is one of the useful schemes to eliminate traffic congestion in strategic scale. However, in the reality, an optimal dynamic congestion pricing is very difficult or impossible to determine theoretically, because road networks are usually large and complicated, and behavior of road users is uncertain. To account for this challenge, this work proposes a dynamic congestion pricing method using deep reinforcement learning (DRL). It is designed to eliminate traffic congestion based on observable data in general large-scale road networks, by leveraging the data-driven nature of deep reinforcement learning. One of the novel elements of the proposed method is the distributed and cooperative learning scheme. Specifically, the DRL is implemented by a spatial-temporally distributed manner, and cooperation among DRL agents is established by novel techniques we call spatially shared reward and temporally switching learning. It enables fast and computationally efficient learning in large-scale networks. The numerical experiments using Sioux Falls Network showed that the proposed method works well thanks to the novel learning scheme.

The concept of a digital twin has exploded in popularity over the past decade, yet confusion around its plurality of definitions, its novelty as a new technology, and its practical applicability still exists, all despite numerous reviews, surveys, and press releases. The history of the term digital twin is explored, as well as its initial context in the fields of product life cycle management, asset maintenance, and equipment fleet management, operations, and planning. A definition for a minimally viable framework to utilize a digital twin is also provided based on seven essential elements. A brief tour through DT applications and industries where DT methods are employed is also outlined. The application of a digital twin framework is highlighted in the field of predictive maintenance, and its extensions utilizing machine learning and physics based modeling. Employing the combination of machine learning and physics based modeling to form hybrid digital twin frameworks, may synergistically alleviate the shortcomings of each method when used in isolation. Key challenges of implementing digital twin models in practice are additionally discussed. As digital twin technology experiences rapid growth and as it matures, its great promise to substantially enhance tools and solutions for intelligent upkeep of complex equipment, are expected to materialize.

Recent attacks have shown that user data can be reconstructed from FedSGD updates, thus breaking privacy. However, these attacks are of limited practical relevance as federated learning typically uses the FedAvg algorithm. It is generally accepted that reconstructing data from FedAvg updates is much harder than FedSGD as: (i) there are unobserved intermediate weight updates, (ii) the order of inputs matters, and (iii) the order of labels changes every epoch. In this work, we propose a new optimization-based attack which successfully attacks FedAvg by addressing the above challenges. First, we solve the optimization problem using automatic differentiation that forces a simulation of the client's update for the reconstructed labels and inputs so as to match the received client update. Second, we address the unknown input order by treating images at different epochs as independent during optimization, while relating them with a permutation invariant prior. Third, we reconstruct the labels by estimating the parameters of existing FedSGD attacks at every FedAvg step. On the popular FEMNIST dataset, we demonstrate that on average we successfully reconstruct >45% of the client's images from realistic FedAvg updates computed on 10 local epochs of 10 batches each with 5 images, compared to only <10% using the baseline. These findings indicate that many real-world federated learning implementations based on FedAvg are vulnerable.

Understanding the long-term evolution of hierarchical triple systems is challenging due to its inherent chaotic nature, and it requires computationally expensive simulations. Here we propose a convolutional neural network model to predict the stability of hierarchical triples by looking at their evolution during the first $5 \times 10^5$ inner binary orbits. We employ the regularized few-body code \textsc{tsunami} to simulate $5\times 10^6$ hierarchical triples, from which we generate a large training and test dataset. We develop twelve different network configurations that use different combinations of the triples' orbital elements and compare their performances. Our best model uses 6 time-series, namely, the semimajor axes ratio, the inner and outer eccentricities, the mutual inclination and the arguments of pericenter. This model achieves an area under the curve of over $95\%$ and informs of the relevant parameters to study triple systems stability. All trained models are made publicly available, allowing to predict the stability of hierarchical triple systems $200$ times faster than pure $N$-body methods.

Semantic segmentation arises as the backbone of many vision systems, spanning from self-driving cars and robot navigation to augmented reality and teleconferencing. Frequently operating under stringent latency constraints within a limited resource envelope, optimising for efficient execution becomes important. At the same time, the heterogeneous capabilities of the target platforms and diverse constraints of different applications require the design and training of multiple target-specific segmentation models, leading to excessive maintenance costs. To this end, we propose a framework for converting state-of-the-art segmentation CNNs to Multi-Exit Semantic Segmentation (MESS) networks: specially trained models that employ parametrised early exits along their depth to i) dynamically save computation during inference on easier samples and ii) save training and maintenance cost by offering a post-training customisable speed-accuracy trade-off. Designing and training such networks naively can hurt performance. Thus, we propose novel two-staged training scheme for multi-exit networks. Furthermore, the parametrisation of MESS enables co-optimising the number, placement and architecture of the attached segmentation heads along with the exit policy, upon deployment via exhaustive search in <1GPUh. This allows MESS to rapidly adapt to the device capabilities and application requirements for each target use-case, offering a train-once-deploy-everywhere solution. MESS variants achieve latency gains of up to 2.83x with the same accuracy, or 5.33 pp higher accuracy for the same computational budget, compared to the original backbone network. Lastly, MESS delivers orders of magnitude faster architecture selection, compared to state-of-the-art techniques.

The COVID-19 outbreak resulted in multiple waves of infections that have been associated with different SARS-CoV-2 variants. Studies have reported differential impact of the variants on respiratory health of patients. We explore whether acoustic signals, collected from COVID-19 subjects, show computationally distinguishable acoustic patterns suggesting a possibility to predict the underlying virus variant. We analyze the Coswara dataset which is collected from three subject pools, namely, i) healthy, ii) COVID-19 subjects recorded during the delta variant dominant period, and iii) data from COVID-19 subjects recorded during the omicron surge. Our findings suggest that multiple sound categories, such as cough, breathing, and speech, indicate significant acoustic feature differences when comparing COVID-19 subjects with omicron and delta variants. The classification areas-under-the-curve are significantly above chance for differentiating subjects infected by omicron from those infected by delta. Using a score fusion from multiple sound categories, we obtained an area-under-the-curve of 89% and 52.4% sensitivity at 95% specificity. Additionally, a hierarchical three class approach was used to classify the acoustic data into healthy and COVID-19 positive, and further COVID-19 subjects into delta and omicron variants providing high level of 3-class classification accuracy. These results suggest new ways for designing sound based COVID-19 diagnosis approaches.

The development of neural vocoders (NVs) has resulted in the high-quality and fast generation of waveforms. However, conventional NVs target a single sampling rate and require re-training when applied to different sampling rates. A suitable sampling rate varies from application to application due to the trade-off between speech quality and generation speed. In this study, we propose a method to handle multiple sampling rates in a single NV, called the MSR-NV. By generating waveforms step-by-step starting from a low sampling rate, MSR-NV can efficiently learn the characteristics of each frequency band and synthesize high-quality speech at multiple sampling rates. It can be regarded as an extension of the previously proposed NVs, and in this study, we extend the structure of Parallel WaveGAN (PWG). Experimental evaluation results demonstrate that the proposed method achieves remarkably higher subjective quality than the original PWG trained separately at 16, 24, and 48 kHz, without increasing the inference time. We also show that MSR-NV can leverage speech with lower sampling rates to further improve the quality of the synthetic speech.

Large language models are shown to memorize privacy information such as social security numbers in training data. Given the sheer scale of the training corpus, it is challenging to screen and filter these privacy data, either manually or automatically. In this paper, we propose Confidentially Redacted Training (CRT), a method to train language generation models while protecting the confidential segments. We borrow ideas from differential privacy (which solves a related but distinct problem) and show that our method is able to provably prevent unintended memorization by randomizing parts of the training process. Moreover, we show that redaction with an approximately correct screening policy amplifies the confidentiality guarantee. We implement the method for both LSTM and GPT language models. Our experimental results show that the models trained by CRT obtain almost the same perplexity while preserving strong confidentiality.

Recent works in self-supervised learning have advanced the state-of-the-art by relying on the contrastive learning paradigm, which learns representations by pushing positive pairs, or similar examples from the same class, closer together while keeping negative pairs far apart. Despite the empirical successes, theoretical foundations are limited -- prior analyses assume conditional independence of the positive pairs given the same class label, but recent empirical applications use heavily correlated positive pairs (i.e., data augmentations of the same image). Our work analyzes contrastive learning without assuming conditional independence of positive pairs using a novel concept of the augmentation graph on data. Edges in this graph connect augmentations of the same data, and ground-truth classes naturally form connected sub-graphs. We propose a loss that performs spectral decomposition on the population augmentation graph and can be succinctly written as a contrastive learning objective on neural net representations. Minimizing this objective leads to features with provable accuracy guarantees under linear probe evaluation. By standard generalization bounds, these accuracy guarantees also hold when minimizing the training contrastive loss. Empirically, the features learned by our objective can match or outperform several strong baselines on benchmark vision datasets. In all, this work provides the first provable analysis for contrastive learning where guarantees for linear probe evaluation can apply to realistic empirical settings.

A key enabler of deploying convolutional neural networks on resource-constrained embedded systems is the binary neural network (BNN). BNNs save on memory and simplify computation by binarizing both features and weights. Unfortunately, binarization is inevitably accompanied by a severe decrease in accuracy. To reduce the accuracy gap between binary and full-precision networks, many repair methods have been proposed in the recent past, which we have classified and put into a single overview in this chapter. The repair methods are divided into two main branches, training techniques and network topology changes, which can further be split into smaller categories. The latter category introduces additional cost (energy consumption or additional area) for an embedded system, while the former does not. From our overview, we observe that progress has been made in reducing the accuracy gap, but BNN papers are not aligned on what repair methods should be used to get highly accurate BNNs. Therefore, this chapter contains an empirical review that evaluates the benefits of many repair methods in isolation over the ResNet-20\&CIFAR10 and ResNet-18\&CIFAR100 benchmarks. We found three repair categories most beneficial: feature binarizer, feature normalization, and double residual. Based on this review we discuss future directions and research opportunities. We sketch the benefit and costs associated with BNNs on embedded systems because it remains to be seen whether BNNs will be able to close the accuracy gap while staying highly energy-efficient on resource-constrained embedded systems.

We propose Graph-Coupled Oscillator Networks (GraphCON), a novel framework for deep learning on graphs. It is based on discretizations of a second-order system of ordinary differential equations (ODEs), which model a network of nonlinear controlled and damped oscillators, coupled via the adjacency structure of the underlying graph. The flexibility of our framework permits any basic GNN layer (e.g. convolutional or attentional) as the coupling function, from which a multi-layer deep neural network is built up via the dynamics of the proposed ODEs. We relate the oversmoothing problem, commonly encountered in GNNs, to the stability of steady states of the underlying ODE and show that zero-Dirichlet energy steady states are not stable for our proposed ODEs. This demonstrates that the proposed framework mitigates the oversmoothing problem. Moreover, we prove that GraphCON mitigates the exploding and vanishing gradients problem to facilitate training of deep multi-layer GNNs. Finally, we show that our approach offers competitive performance with respect to the state-of-the-art on a variety of graph-based learning tasks.

In this paper, we present SANE-TTS, a stable and natural end-to-end multilingual TTS model. By the difficulty of obtaining multilingual corpus for given speaker, training multilingual TTS model with monolingual corpora is unavoidable. We introduce speaker regularization loss that improves speech naturalness during cross-lingual synthesis as well as domain adversarial training, which is applied in other multilingual TTS models. Furthermore, by adding speaker regularization loss, replacing speaker embedding with zero vector in duration predictor stabilizes cross-lingual inference. With this replacement, our model generates speeches with moderate rhythm regardless of source speaker in cross-lingual synthesis. In MOS evaluation, SANE-TTS achieves naturalness score above 3.80 both in cross-lingual and intralingual synthesis, where the ground truth score is 3.99. Also, SANE-TTS maintains speaker similarity close to that of ground truth even in cross-lingual inference. Audio samples are available on our web page.

Equipping current decision-making tools with notions of fairness, equitability, or other ethically motivated outcomes, is one of the top priorities in recent research efforts in machine learning, AI, and optimization. In this paper, we investigate how to allocate limited resources to {locally interacting} communities in a way to maximize a pertinent notion of equitability. In particular, we look at the dynamic setting where the allocation is repeated across multiple periods (e.g., yearly), the local communities evolve in the meantime (driven by the provided allocation), and the allocations are modulated by feedback coming from the communities themselves. We employ recent mathematical tools stemming from data-driven feedback online optimization, by which communities can learn their (possibly unknown) evolution, satisfaction, as well as they can share information with the deciding bodies. We design dynamic policies that converge to an allocation that maximize equitability in the long term. We further demonstrate our model and methodology with realistic examples of healthcare and education subsidies design in Sub-Saharian countries. One of the key empirical takeaways from our setting is that long-term equitability is fragile, in the sense that it can be easily lost when deciding bodies weigh in other factors (e.g., equality in allocation) in the allocation strategy. Moreover, a naive compromise, while not providing significant advantage to the communities, can promote inequality in social outcomes.

We develop an end-to-end deep-neural-network-based algorithm for classifying animal behavior using accelerometry data on the embedded system of an artificial intelligence of things (AIoT) device installed in a wearable collar tag. The proposed algorithm jointly performs feature extraction and classification utilizing a set of infinite-impulse-response (IIR) and finite-impulse-response (FIR) filters together with a multilayer perceptron. The utilized IIR and FIR filters can be viewed as specific types of recurrent and convolutional neural network layers, respectively. We evaluate the performance of the proposed algorithm via two real-world datasets collected from total eighteen grazing beef cattle using collar tags. The results show that the proposed algorithm offers good intra- and inter-dataset classification accuracy and outperforms its closest contenders including two state-of-the-art convolutional-neural-network-based time-series classification algorithms, which are significantly more complex. We implement the proposed algorithm on the embedded system of the utilized collar tags' AIoT device to perform in-situ classification of animal behavior. We achieve real-time in-situ behavior inference from accelerometry data without imposing any strain on the available computational, memory, or energy resources of the embedded system.

Machine learning has been applied to almost all fields of computer science over the past decades. The introduction of GANs allowed for new possibilities in fields of medical research and text prediction. However, these new fields work with ever more privacy-sensitive data. In order to maintain user privacy, a combination of federated learning, differential privacy and GANs can be used to work with private data without giving away a users' privacy. Recently, two implementations of such combinations have been published: DP-Fed-Avg GAN and GS-WGAN. This paper compares their performance and introduces an alternative version of DP-Fed-Avg GAN that makes use of denoising techniques to combat the loss in accuracy that generally occurs when applying differential privacy and federated learning to GANs. We also compare the novel adaptation of denoised DP-Fed-Avg GAN to the state-of-the-art implementations in this field.

In this work, we introduce NU-Wave, the first neural audio upsampling model to produce waveforms of sampling rate 48kHz from coarse 16kHz or 24kHz inputs, while prior works could generate only up to 16kHz. NU-Wave is the first diffusion probabilistic model for audio super-resolution which is engineered based on neural vocoders. NU-Wave generates high-quality audio that achieves high performance in terms of signal-to-noise ratio (SNR), log-spectral distance (LSD), and accuracy of the ABX test. In all cases, NU-Wave outperforms the baseline models despite the substantially smaller model capacity (3.0M parameters) than baselines (5.4-21%). The audio samples of our model are available at https://mindslab-ai.github.io/nuwave, and the code will be made available soon.

Score-based generative models are a new class of generative algorithms that have been shown to produce realistic images even in high dimensional spaces, currently surpassing other state-of-the-art models for different benchmark categories and applications. In this work we introduce CaloScore, a score-based generative model for collider physics applied to calorimeter shower generation. Three different diffusion models are investigated using the Fast Calorimeter Simulation Challenge 2022 dataset. CaloScore is the first application of a score-based generative model in collider physics and is able to produce high-fidelity calorimeter images for all datasets, providing an alternative paradigm for calorimeter shower simulation.

Federated learning (FL) is a system in which a central aggregator coordinates the efforts of multiple clients to solve machine learning problems. This setting allows training data to be dispersed in order to protect privacy. The purpose of this paper is to provide an overview of FL systems with a focus on healthcare. FL is evaluated here based on its frameworks, architectures, and applications. It is shown here that FL solves the preceding issues with a shared global deep learning (DL) model via a central aggregator server. This paper examines recent developments and provides a comprehensive list of unresolved issues, inspired by the rapid growth of FL research. In the context of FL, several privacy methods are described, including secure multiparty computation, homomorphic encryption, differential privacy, and stochastic gradient descent. Furthermore, a review of various FL classes, such as horizontal and vertical FL and federated transfer learning, is provided. FL has applications in wireless communication, service recommendation, intelligent medical diagnosis systems, and healthcare, all of which are discussed in this paper. We also present a thorough review of existing FL challenges, such as privacy protection, communication cost, system heterogeneity, and unreliable model upload, followed by future research directions.

Domain Generalization (DG) aims to learn models whose performance remains high on unseen domains encountered at test-time by using data from multiple related source domains. Many existing DG algorithms reduce the divergence between source distributions in a representation space to potentially align the unseen domain close to the sources. This is motivated by the analysis that explains generalization to unseen domains using distributional distance (such as the Wasserstein distance) to the sources. However, due to the openness of the DG objective, it is challenging to evaluate DG algorithms comprehensively using a few benchmark datasets. In particular, we demonstrate that the accuracy of the models trained with DG methods varies significantly across unseen domains, generated from popular benchmark datasets. This highlights that the performance of DG methods on a few benchmark datasets may not be representative of their performance on unseen domains in the wild. To overcome this roadblock, we propose a universal certification framework based on distributionally robust optimization (DRO) that can efficiently certify the worst-case performance of any DG method. This enables a data-independent evaluation of a DG method complementary to the empirical evaluations on benchmark datasets. Furthermore, we propose a training algorithm that can be used with any DG method to provably improve their certified performance. Our empirical evaluation demonstrates the effectiveness of our method at significantly improving the worst-case loss (i.e., reducing the risk of failure of these models in the wild) without incurring a significant performance drop on benchmark datasets.

It is well-known that deep learning models are vulnerable to adversarial examples. Existing studies of adversarial training have made great progress against this challenge. As a typical trait, they often assume that the class distribution is overall balanced. However, long-tail datasets are ubiquitous in a wide spectrum of applications, where the amount of head class instances is larger than the tail classes. Under such a scenario, AUC is a much more reasonable metric than accuracy since it is insensitive toward class distribution. Motivated by this, we present an early trial to explore adversarial training methods to optimize AUC. The main challenge lies in that the positive and negative examples are tightly coupled in the objective function. As a direct result, one cannot generate adversarial examples without a full scan of the dataset. To address this issue, based on a concavity regularization scheme, we reformulate the AUC optimization problem as a saddle point problem, where the objective becomes an instance-wise function. This leads to an end-to-end training protocol. Furthermore, we provide a convergence guarantee of the proposed algorithm. Our analysis differs from the existing studies since the algorithm is asked to generate adversarial examples by calculating the gradient of a min-max problem. Finally, the extensive experimental results show the performance and robustness of our algorithm in three long-tail datasets.

Graph Neural Networks (GNNs) have emerged as a powerful technique for learning on relational data. Owing to the relatively limited number of message passing steps they perform -- and hence a smaller receptive field -- there has been significant interest in improving their expressivity by incorporating structural aspects of the underlying graph. In this paper, we explore the use of affinity measures as features in graph neural networks, in particular measures arising from random walks, including effective resistance, hitting and commute times. We propose message passing networks based on these features and evaluate their performance on a variety of node and graph property prediction tasks. Our architecture has lower computational complexity, while our features are invariant to the permutations of the underlying graph. The measures we compute allow the network to exploit the connectivity properties of the graph, thereby allowing us to outperform relevant benchmarks for a wide variety of tasks, often with significantly fewer message passing steps. On one of the largest publicly available graph regression datasets, OGB-LSC-PCQM4Mv1, we obtain the best known single-model validation MAE at the time of writing.

This paper proposes an effective and novel multiagent deep reinforcement learning (MADRL)-based method for solving the joint virtual network function (VNF) placement and routing (P&R), where multiple service requests with differentiated demands are delivered at the same time. The differentiated demands of the service requests are reflected by their delay- and cost-sensitive factors. We first construct a VNF P&R problem to jointly minimize a weighted sum of service delay and resource consumption cost, which is NP-complete. Then, the joint VNF P&R problem is decoupled into two iterative subtasks: placement subtask and routing subtask. Each subtask consists of multiple concurrent parallel sequential decision processes. By invoking the deep deterministic policy gradient method and multi-agent technique, an MADRL-P&R framework is designed to perform the two subtasks. The new joint reward and internal rewards mechanism is proposed to match the goals and constraints of the placement and routing subtasks. We also propose the parameter migration-based model-retraining method to deal with changing network topologies. Corroborated by experiments, the proposed MADRL-P&R framework is superior to its alternatives in terms of service cost and delay, and offers higher flexibility for personalized service demands. The parameter migration-based model-retraining method can efficiently accelerate convergence under moderate network topology changes.

It is widely believed that the success of deep networks lies in their ability to learn a meaningful representation of the features of the data. Yet, understanding when and how this feature learning improves performance remains a challenge: for example, it is beneficial for modern architectures trained to classify images, whereas it is detrimental for fully-connected networks trained for the same task on the same data. Here we propose an explanation for this puzzle, by showing that feature learning can perform worse than lazy training (via random feature kernel or the NTK) as the former can lead to a sparser neural representation. Although sparsity is known to be essential for learning anisotropic data, it is detrimental when the target function is constant or smooth along certain directions of input space. We illustrate this phenomenon in two settings: (i) regression of Gaussian random functions on the d-dimensional unit sphere and (ii) classification of benchmark datasets of images. For (i), we compute the scaling of the generalization error with number of training points, and show that methods that do not learn features generalize better, even when the dimension of the input space is large. For (ii), we show empirically that learning features can indeed lead to sparse and thereby less smooth representations of the image predictors. This fact is plausibly responsible for deteriorating the performance, which is known to be correlated with smoothness along diffeomorphisms.

Detecting out-of-distribution inputs is critical for safe deployment of machine learning models in the real world. However, neural networks are known to suffer from the overconfidence issue, where they produce abnormally high confidence for both in- and out-of-distribution inputs. In this work, we show that this issue can be mitigated through Logit Normalization (LogitNorm) -- a simple fix to the cross-entropy loss -- by enforcing a constant vector norm on the logits in training. Our method is motivated by the analysis that the norm of the logit keeps increasing during training, leading to overconfident output. Our key idea behind LogitNorm is thus to decouple the influence of output's norm during network optimization. Trained with LogitNorm, neural networks produce highly distinguishable confidence scores between in- and out-of-distribution data. Extensive experiments demonstrate the superiority of LogitNorm, reducing the average FPR95 by up to 42.30% on common benchmarks.

Objective assessment of Magnetic Resonance Imaging (MRI) scans of osteoarthritis (OA) can address the limitation of the current OA assessment. Segmentation of bone, cartilage, and joint fluid is necessary for the OA objective assessment. Most of the proposed segmentation methods are not performing instance segmentation and suffer from class imbalance problems. This study deployed Mask R-CNN instance segmentation and improved it (improved-Mask R-CNN (iMaskRCNN)) to obtain a more accurate generalized segmentation for OA-associated tissues. Training and validation of the method were performed using 500 MRI knees from the Osteoarthritis Initiative (OAI) dataset and 97 MRI scans of patients with symptomatic hip OA. Three modifications to Mask R-CNN yielded the iMaskRCNN: adding a 2nd ROIAligned block, adding an extra decoder layer to the mask-header, and connecting them by a skip connection. The results were assessed using Hausdorff distance, dice score, and coefficients of variation (CoV). The iMaskRCNN led to improved bone and cartilage segmentation compared to Mask RCNN as indicated with the increase in dice score from 95% to 98% for the femur, 95% to 97% for tibia, 71% to 80% for femoral cartilage, and 81% to 82% for tibial cartilage. For the effusion detection, dice improved with iMaskRCNN 72% versus MaskRCNN 71%. The CoV values for effusion detection between Reader1 and Mask R-CNN (0.33), Reader1 and iMaskRCNN (0.34), Reader2 and Mask R-CNN (0.22), Reader2 and iMaskRCNN (0.29) are close to CoV between two readers (0.21), indicating a high agreement between the human readers and both Mask R-CNN and iMaskRCNN. Mask R-CNN and iMaskRCNN can reliably and simultaneously extract different scale articular tissues involved in OA, forming the foundation for automated assessment of OA. The iMaskRCNN results show that the modification improved the network performance around the edges.

We propose an input sparsity time sampling algorithm that can spectrally approximate the Gram matrix corresponding to the $q$-fold column-wise tensor product of $q$ matrices using a nearly optimal number of samples, improving upon all previously known methods by poly$(q)$ factors. Furthermore, for the important special case of the $q$-fold self-tensoring of a dataset, which is the feature matrix of the degree-$q$ polynomial kernel, the leading term of our method's runtime is proportional to the size of the input dataset and has no dependence on $q$. Previous techniques either incur poly$(q)$ slowdowns in their runtime or remove the dependence on $q$ at the expense of having sub-optimal target dimension, and depend quadratically on the number of data-points in their runtime. Our sampling technique relies on a collection of $q$ partially correlated random projections which can be simultaneously applied to a dataset $X$ in total time that only depends on the size of $X$, and at the same time their $q$-fold Kronecker product acts as a near-isometry for any fixed vector in the column span of $X^{\otimes q}$. We also show that our sampling methods generalize to other classes of kernels beyond polynomial, such as Gaussian and Neural Tangent kernels.

Recently discovered polyhedral structures of the value function for finite state-action discounted Markov decision processes (MDP) shed light on understanding the success of reinforcement learning. We investigate the value function polytope in greater detail and characterize the polytope boundary using a hyperplane arrangement. We further show that the value space is a union of finitely many cells of the same hyperplane arrangement and relate it to the polytope of the classical linear programming formulation for MDPs. Inspired by these geometric properties, we propose a new algorithm, Geometric Policy Iteration (GPI), to solve discounted MDPs. GPI updates the policy of a single state by switching to an action that is mapped to the boundary of the value function polytope, followed by an immediate update of the value function. This new update rule aims at a faster value improvement without compromising computational efficiency. Moreover, our algorithm allows asynchronous updates of state values which is more flexible and advantageous compared to traditional policy iteration when the state set is large. We prove that the complexity of GPI achieves the best known bound $\mathcal{O}\left(\frac{|\mathcal{A}|}{1 - \gamma}\log \frac{1}{1-\gamma}\right)$ of policy iteration and empirically demonstrate the strength of GPI on MDPs of various sizes.

Self-supervised speech recognition models require considerable labeled training data for learning high-fidelity representations for Automatic Speech Recognition (ASR) which is computationally demanding and time-consuming, thereby hindering the usage of these models in resource-constrained environments. We consider the task of identifying an optimal subset of data to train self-supervised speech models for ASR. We make a surprising observation that the dataset pruning strategies used in vision tasks for sampling the most informative examples do not perform better than random subset selection on the task of fine-tuning self-supervised ASR. We then present the COWERAGE algorithm for better subset selection in self-supervised ASR, which is based on our finding that ensuring the coverage of examples based on training Word Error Rate (WER) in the early training epochs leads to better generalization performance. Extensive experiments on the wav2vec 2.0 model and TIMIT, Librispeech, and LJSpeech datasets show the effectiveness of COWERAGE, with up to 17% absolute WER improvement over existing dataset pruning methods and random sampling. We also demonstrate that the coverage of training instances in terms of WER ensures inclusion of phonemically diverse examples which leads to better test accuracy in self-supervised speech recognition models.

During the training of machine learning models, they may store or "learn" more information about the training data than what is actually needed for the prediction or classification task. This is exploited by property inference attacks which aim at extracting statistical properties from the training data of a given model without having access to the training data itself. These properties may include the quality of pictures to identify the camera model, the age distribution to reveal the target audience of a product, or the included host types to refine a malware attack in computer networks. This attack is especially accurate when the attacker has access to all model parameters, i.e., in a white-box scenario. By defending against such attacks, model owners are able to ensure that their training data, associated properties, and thus their intellectual property stays private, even if they deliberately share their models, e.g., to train collaboratively, or if models are leaked. In this paper, we introduce property unlearning, an effective defense mechanism against white-box property inference attacks, independent of the training data type, model task, or number of properties. Property unlearning mitigates property inference attacks by systematically changing the trained weights and biases of a target model such that an adversary cannot extract chosen properties. We empirically evaluate property unlearning on three different data sets, including tabular and image data, and two types of artificial neural networks. Our results show that property unlearning is both efficient and reliable to protect machine learning models against property inference attacks, with a good privacy-utility trade-off. Furthermore, our approach indicates that this mechanism is also effective to unlearn multiple properties.

In this work, we propose a new deep learning-based scheme for solving high dimensional nonlinear backward stochastic differential equations (BSDEs). The idea is to reformulate the problem as a global optimization, where the local loss functions are included. Essentially, we approximate the unknown solution of a BSDE using a deep neural network and its gradient with automatic differentiation. The approximations are performed by globally minimizing the quadratic local loss function defined at each time step, which always includes the terminal condition. This kind of loss functions are obtained by iterating the Euler discretization of the time integrals with the terminal condition. Our formulation can prompt the stochastic gradient descent algorithm not only to take the accuracy at each time layer into account, but also converge to a good local minima. In order to demonstrate performances of our algorithm, several high-dimensional nonlinear BSDEs including pricing problems in finance are provided.

Correlation clustering is a widely studied framework for clustering based on pairwise similarity and dissimilarity scores, but its best approximation algorithms rely on impractical linear programming relaxations. We present faster approximation algorithms that avoid these relaxations, for two well-studied special cases: cluster editing and cluster deletion. We accomplish this by drawing new connections to edge labeling problems related to the principle of strong triadic closure. This leads to faster and more practical linear programming algorithms, as well as extremely scalable combinatorial techniques, including the first combinatorial approximation algorithm for cluster deletion. In practice, our algorithms produce approximate solutions that nearly match the best algorithms in quality, while scaling to problems that are orders of magnitude larger.

Modern neuroimaging techniques, such as diffusion tensor imaging (DTI) and functional magnetic resonance imaging (fMRI), enable us to model the human brain as a brain network or connectome. Capturing brain networks' structural information and hierarchical patterns is essential for understanding brain functions and disease states. Recently, the promising network representation learning capability of graph neural networks (GNNs) has prompted many GNN-based methods for brain network analysis to be proposed. Specifically, these methods apply feature aggregation and global pooling to convert brain network instances into meaningful low-dimensional representations used for downstream brain network analysis tasks. However, existing GNN-based methods often neglect that brain networks of different subjects may require various aggregation iterations and use GNN with a fixed number of layers to learn all brain networks. Therefore, how to fully release the potential of GNNs to promote brain network analysis is still non-trivial. To solve this problem, we propose a novel brain network representation framework, namely BN-GNN, which searches for the optimal GNN architecture for each brain network. Concretely, BN-GNN employs deep reinforcement learning (DRL) to train a meta-policy to automatically determine the optimal number of feature aggregations (reflected in the number of GNN layers) required for a given brain network. Extensive experiments on eight real-world brain network datasets demonstrate that our proposed BN-GNN improves the performance of traditional GNNs on different brain network analysis tasks.

Data continuously emitted from industrial ecosystems such as social or commerce platforms are commonly represented as heterogeneous graphs (HG) composed of multiple node/edge types. State-of-the-art graph learning methods for HGs known as heterogeneous graph neural networks (HGNNs) are applied to learn deep context-informed node representations. However, many HG datasets from industrial applications suffer from label imbalance between node types. As there is no direct way to learn using labels rooted at different node types, HGNNs have been applied to only a few node types with abundant labels. We propose a zero-shot transfer learning module for HGNNs called a Knowledge Transfer Network (KTN) that transfers knowledge from label-abundant node types to zero-labeled node types through rich relational information given in the HG. KTN is derived from the theoretical relationship, which we introduce in this work, between distinct feature extractors for each node type given in an HGNN model. KTN improves the performance of 6 different types of HGNN models by up to 960% for inference on zero-labeled node types and outperforms state-of-the-art transfer learning baselines by up to 73% across 18 different transfer learning tasks on HGs.

Artificial Neural Networks (ANNs) are prevalent machine learning models that are applied across various real-world classification tasks. However, training ANNs is time-consuming and the resulting models take a lot of memory to deploy. In order to train more parsimonious ANNs, we propose a novel mixed-integer programming (MIP) formulation for training fully-connected ANNs. Our formulations can account for both binary and rectified linear unit (ReLU) activations, and for the use of a log-likelihood loss. We present numerical experiments comparing our MIP-based methods against existing approaches and show that we are able to achieve competitive out-of-sample performance with more parsimonious models.

In federated learning (FL), model performance typically suffers from client drift induced by data heterogeneity, and mainstream works focus on correcting client drift. We propose a different approach named virtual homogeneity learning (VHL) to directly "rectify" the data heterogeneity. In particular, VHL conducts FL with a virtual homogeneous dataset crafted to satisfy two conditions: containing no private information and being separable. The virtual dataset can be generated from pure noise shared across clients, aiming to calibrate the features from the heterogeneous clients. Theoretically, we prove that VHL can achieve provable generalization performance on the natural distribution. Empirically, we demonstrate that VHL endows FL with drastically improved convergence speed and generalization performance. VHL is the first attempt towards using a virtual dataset to address data heterogeneity, offering new and effective means to FL.

Kernel-based bandit is an extensively studied black-box optimization problem, in which the objective function is assumed to live in a known reproducing kernel Hilbert space. While nearly optimal regret bounds (up to logarithmic factors) are established in the noisy setting, surprisingly, less is known about the noise-free setting (when the exact values of the underlying function is accessible without observation noise). We discuss several upper bounds on regret; none of which seem order optimal, and provide a conjecture on the order optimal regret bound.

End-to-end AutoML has attracted intensive interests from both academia and industry which automatically searches for ML pipelines in a space induced by feature engineering, algorithm/model selection, and hyper-parameter tuning. Existing AutoML systems, however, suffer from scalability issues when applying to application domains with large, high-dimensional search spaces. We present VolcanoML, a scalable and extensible framework that facilitates systematic exploration of large AutoML search spaces. VolcanoML introduces and implements basic building blocks that decompose a large search space into smaller ones, and allows users to utilize these building blocks to compose an execution plan for the AutoML problem at hand. VolcanoML further supports a Volcano-style execution model -- akin to the one supported by modern database systems -- to execute the plan constructed. Our evaluation demonstrates that, not only does VolcanoML raise the level of expressiveness for search space decomposition in AutoML, it also leads to actual findings of decomposition strategies that are significantly more efficient than the ones employed by state-of-the-art AutoML systems such as auto-sklearn. This paper is the extended version of the initial VolcanoML paper appeared in VLDB 2021.

Self-attention, an architectural motif designed to model long-range interactions in sequential data, has driven numerous recent breakthroughs in natural language processing and beyond. This work provides a theoretical analysis of the inductive biases of self-attention modules. Our focus is to rigorously establish which functions and long-range dependencies self-attention blocks prefer to represent. Our main result shows that bounded-norm Transformer networks "create sparse variables": a single self-attention head can represent a sparse function of the input sequence, with sample complexity scaling only logarithmically with the context length. To support our analysis, we present synthetic experiments to probe the sample complexity of learning sparse Boolean functions with Transformers.

Data-driven approaches to modeling physical systems fail to generalize to unseen systems that share the same general dynamics with the learning domain, but correspond to different physical contexts. We propose a new framework for this key problem, context-informed dynamics adaptation (CoDA), which takes into account the distributional shift across systems for fast and efficient adaptation to new dynamics. CoDA leverages multiple environments, each associated to a different dynamic, and learns to condition the dynamics model on contextual parameters, specific to each environment. The conditioning is performed via a hypernetwork, learned jointly with a context vector from observed data. The proposed formulation constrains the search hypothesis space to foster fast adaptation and better generalization across environments. We theoretically motivate our approach and show state-of-the-art generalization results on a set of nonlinear dynamics, representative of a variety of application domains. We also show, on these systems, that new system parameters can be inferred from context vectors with minimal supervision. Code is available at https://github.com/yuan-yin/CoDA .

Renewable energy resources (RERs) have been increasingly integrated into large-scale distributed power systems. Considering uncertainties and voltage fluctuation issues introduced by RERs, in this paper, we propose a deep reinforcement learning (DRL)-based strategy leveraging spatial-temporal (ST) graphical information of power systems, to dynamically search for the optimal operation, i.e., optimal power flow (OPF), of power systems with a high uptake of RERs. Specifically, we formulate the OPF problem as a multi-objective optimization problem considering generation cost, voltage fluctuation, and transmission loss, and employ deep deterministic policy gradient (DDPG) to learn an optimal allocation strategy for OPF. Moreover, given that the nodes in power systems are self-correlated and interrelated in temporal and spatial views, we develop a multi-grained attention-based spatial-temporal graph convolution network (MG-ASTGCN) for extracting ST graphical correlations and features, aiming to provide prior knowledge of power systems for its sequential DDPG algorithm to more effectively solve OPF. We validate our algorithm on modified IEEE 33, 69, and 118-bus radial distribution systems and demonstrate that our algorithm outperforms other benchmark algorithms. Our experimental results also reveal that our MG-ASTGCN can significantly accelerate DDPG's training process and performance in solving OPF.

Adversarial patch attacks that inject arbitrary distortions within a bounded region of an image, can trigger misclassification in deep neural networks (DNNs). These attacks are robust (i.e., physically realizable) and universally malicious, and hence represent a severe security threat to real-world DNN-based systems. This work proposes Jujutsu, a two-stage technique to detect and mitigate robust and universal adversarial patch attacks. We first observe that patch attacks often yield large influence on the prediction output in order to dominate the prediction on any input, and Jujutsu is built to expose this behavior for effective attack detection. For mitigation, we observe that patch attacks corrupt only a localized region while the remaining contents are unperturbed, based on which Jujutsu leverages GAN-based image inpainting to synthesize the semantic contents in the pixels that are corrupted by the attacks, and reconstruct the ``clean'' image for correct prediction. We evaluate Jujutsu on four diverse datasets and show that it achieves superior performance and significantly outperforms four leading defenses. Jujutsu can further defend against physical-world attacks, attacks that target diverse classes, and adaptive attacks. Our code is available at https://github.com/DependableSystemsLab/Jujutsu.

The rapid escalation of applying Machine Learning (ML) in various domains has led to paying more attention to the quality of ML components. There is then a growth of techniques and tools aiming at improving the quality of ML components and integrating them into the ML-based system safely. Although most of these tools use bugs' lifecycle, there is no standard benchmark of bugs to assess their performance, compare them and discuss their advantages and weaknesses. In this study, we firstly investigate the reproducibility and verifiability of the bugs in ML-based systems and show the most important factors in each one. Then, we explore the challenges of generating a benchmark of bugs in ML-based software systems and provide a bug benchmark namely defect4ML that satisfies all criteria of standard benchmark, i.e. relevance, reproducibility, fairness, verifiability, and usability. This faultload benchmark contains 113 bugs reported by ML developers on GitHub and Stack Overflow, using two of the most popular ML frameworks: TensorFlow and Keras. defect4ML also addresses important challenges in Software Reliability Engineering of ML-based software systems, like: 1) fast changes in frameworks, by providing various bugs for different versions of frameworks, 2) code portability, by delivering similar bugs in different ML frameworks, 3) bug reproducibility, by providing fully reproducible bugs with complete information about required dependencies and data, and 4) lack of detailed information on bugs, by presenting links to the bugs' origins. defect4ML can be of interest to ML-based systems practitioners and researchers to assess their testing tools and techniques.

Sampling is a critical operation in Graph Neural Network (GNN) training that helps reduce the cost. Previous literature has explored improving sampling algorithms via mathematical and statistical methods. However, there is a gap between sampling algorithms and hardware. Without consideration of hardware, algorithm designers merely optimize sampling at the algorithm level, missing the great potential of promoting the efficiency of existing sampling algorithms by leveraging hardware features. In this paper, we pioneer to propose a unified programming model for mainstream sampling algorithms, termed GNNSampler, covering the critical processes of sampling algorithms in various categories. Second, to leverage the hardware feature, we choose the data locality as a case study, and explore the data locality among nodes and their neighbors in a graph to alleviate irregular memory access in sampling. Third, we implement locality-aware optimizations in GNNSampler for various sampling algorithms to optimize the general sampling process. Finally, we emphatically conduct experiments on large graph datasets to analyze the relevance among training time, accuracy, and hardware-level metrics. Extensive experiments show that our method is universal to mainstream sampling algorithms and helps significantly reduce the training time, especially in large-scale graphs.

While deep neural networks have achieved great success in graph analysis, recent work has shown that they are vulnerable to adversarial attacks. Compared with adversarial attacks on image classification, performing adversarial attacks on graphs is more challenging because of the discrete and non-differential nature of the adjacent matrix for a graph. In this work, we propose Cluster Attack -- a Graph Injection Attack (GIA) on node classification, which injects fake nodes into the original graph to degenerate the performance of graph neural networks (GNNs) on certain victim nodes while affecting the other nodes as little as possible. We demonstrate that a GIA problem can be equivalently formulated as a graph clustering problem; thus, the discrete optimization problem of the adjacency matrix can be solved in the context of graph clustering. In particular, we propose to measure the similarity between victim nodes by a metric of Adversarial Vulnerability, which is related to how the victim nodes will be affected by the injected fake node, and to cluster the victim nodes accordingly. Our attack is performed in a practical and unnoticeable query-based black-box manner with only a few nodes on the graphs that can be accessed. Theoretical analysis and extensive experiments demonstrate the effectiveness of our method by fooling the node classifiers with only a small number of queries.

This paper introduces a novel and generic framework to solve the flagship task of supervised labeled graph prediction by leveraging Optimal Transport tools. We formulate the problem as regression with the Fused Gromov-Wasserstein (FGW) loss and propose a predictive model relying on a FGW barycenter whose weights depend on inputs. First we introduce a non-parametric estimator based on kernel ridge regression for which theoretical results such as consistency and excess risk bound are proved. Next we propose an interpretable parametric model where the barycenter weights are modeled with a neural network and the graphs on which the FGW barycenter is calculated are additionally learned. Numerical experiments show the strength of the method and its ability to interpolate in the labeled graph space on simulated data and on a difficult metabolic identification problem where it can reach very good performance with very little engineering.

We develop ShiftMatch, a new training-data-dependent likelihood for out of distribution (OOD) robustness in Bayesian neural networks (BNNs). ShiftMatch is inspired by the training-data-dependent "EmpCov" priors from Izmailov et al. (2021a) and efficiently matches test-time spatial correlations to those at training time. Critically, ShiftMatch is designed to leave neural network training unchanged, allowing it to use publically available samples from pretrained BNNs. Using pre-trained HMC samples, ShiftMatch gives strong performance improvements on CIFAR-10-C, outperforms EmpCov priors, and is perhaps the first Bayesian method capable of convincingly outperforming plain deep ensembles. ShiftMatch can be integrated with non-Bayesian methods like deep ensembles, where it offers smaller, but still considerable, performance improvements. Overall, Bayesian ShiftMatch gave slightly better accuracy than ensembles with ShiftMatch, though they both had very similar log-likelihoods.

Machine learning (ML) robustness and domain generalization are fundamentally correlated: they essentially concern data distribution shifts under adversarial and natural settings, respectively. On one hand, recent studies show that more robust (adversarially trained) models are more generalizable. On the other hand, there is a lack of theoretical understanding of their fundamental connections. In this paper, we explore the relationship between regularization and domain transferability considering different factors such as norm regularization and data augmentations (DA). We propose a general theoretical framework proving that factors involving the model function class regularization are sufficient conditions for relative domain transferability. Our analysis implies that ``robustness" is neither necessary nor sufficient for transferability; rather, regularization is a more fundamental perspective for understanding domain transferability. We then discuss popular DA protocols (including adversarial training) and show when they can be viewed as the function class regularization under certain conditions and therefore improve generalization. We conduct extensive experiments to verify our theoretical findings and show several counterexamples where robustness and generalization are negatively correlated on different datasets.

Reconfigurable Intelligent Surfaces (RISs) have been recently considered as an energy-efficient solution for future wireless networks due to their fast and low-power configuration, which has increased potential in enabling massive connectivity and low-latency communications. Accurate and low-overhead channel estimation in RIS-based systems is one of the most critical challenges due to the usually large number of RIS unit elements and their distinctive hardware constraints. In this paper, we focus on the uplink of a RIS-empowered multi-user Multiple Input Single Output (MISO) uplink communication systems and propose a channel estimation framework based on the parallel factor decomposition to unfold the resulting cascaded channel model. We present two iterative estimation algorithms for the channels between the base station and RIS, as well as the channels between RIS and users. One is based on alternating least squares (ALS), while the other uses vector approximate message passing to iteratively reconstruct two unknown channels from the estimated vectors. To theoretically assess the performance of the ALS-based algorithm, we derived its estimation Cram\'er-Rao Bound (CRB). We also discuss the downlink achievable sum rate computation with estimated channels and different precoding schemes for the base station. Our extensive simulation results show that our algorithms outperform benchmark schemes and that the ALS technique achieves the CRB. It is also demonstrated that the sum rate using the estimated channels always reach that of perfect channels under various settings, thus, verifying the effectiveness and robustness of the proposed estimation algorithms.

Graph diffusion problems such as the propagation of rumors, computer viruses, or smart grid failures are ubiquitous and societal. Hence it is usually crucial to identify diffusion sources according to the current graph diffusion observations. Despite its tremendous necessity and significance in practice, source localization, as the inverse problem of graph diffusion, is extremely challenging as it is ill-posed: different sources may lead to the same graph diffusion patterns. Different from most traditional source localization methods, this paper focuses on a probabilistic manner to account for the uncertainty of different candidate sources. Such endeavors require overcoming challenges including 1) the uncertainty in graph diffusion source localization is hard to be quantified; 2) the complex patterns of the graph diffusion sources are difficult to be probabilistically characterized; 3) the generalization under any underlying diffusion patterns is hard to be imposed. To solve the above challenges, this paper presents a generic framework: Source Localization Variational AutoEncoder (SL-VAE) for locating the diffusion sources under arbitrary diffusion patterns. Particularly, we propose a probabilistic model that leverages the forward diffusion estimation model along with deep generative models to approximate the diffusion source distribution for quantifying the uncertainty. SL-VAE further utilizes prior knowledge of the source-observation pairs to characterize the complex patterns of diffusion sources by a learned generative prior. Lastly, a unified objective that integrates the forward diffusion estimation model is derived to enforce the model to generalize under arbitrary diffusion patterns. Extensive experiments are conducted on 7 real-world datasets to demonstrate the superiority of SL-VAE in reconstructing the diffusion sources by excelling other methods on average 20% in AUC score.

In statistical learning, many problem formulations have been proposed so far, such as multi-class learning, complementarily labeled learning, multi-label learning, multi-task learning, which provide theoretical models for various real-world tasks. Although they have been extensively studied, the relationship among them has not been fully investigated. In this work, we focus on a particular problem formulation called Multiple-Instance Learning (MIL), and show that various learning problems including all the problems mentioned above with some of new problems can be reduced to MIL with theoretically guaranteed generalization bounds, where the reductions are established under a new reduction scheme we provide as a by-product. The results imply that the MIL-reduction gives a simplified and unified framework for designing and analyzing algorithms for various learning problems. Moreover, we show that the MIL-reduction framework can be kernelized.

Automated machine learning (AutoML) is an important step to make machine learning models being widely applied to solve real world problems. Despite numerous research advancement, machine learning methods are not fully utilized by industries mainly due to their data privacy and security regulations, high cost involved in storing and computing increasing amount of data at central location and most importantly lack of expertise. Hence, we introduce a novel framework, HANF - $\textbf{H}$yperparameter $\textbf{A}$nd $\textbf{N}$eural architecture search in $\textbf{F}$ederated learning as a step towards building an AutoML framework for data distributed across several data owner servers without any need for bringing the data to a central location. HANF jointly optimizes a neural architecture and non-architectural hyperparameters of a learning algorithm using gradient-based neural architecture search and $n$-armed bandit approach respectively in data distributed setting. We show that HANF efficiently finds the optimized neural architecture and also tunes the hyperparameters on data owner servers. Additionally, HANF can be applied in both, federated and non-federated settings. Empirically, we show that HANF converges towards well-suited architectures and non-architectural hyperparameter-sets using image-classification tasks.

In this paper, we propose an algorithmic framework, dubbed inertial alternating direction methods of multipliers (iADMM), for solving a class of nonconvex nonsmooth multiblock composite optimization problems with linear constraints. Our framework employs the general minimization-majorization (MM) principle to update each block of variables so as to not only unify the convergence analysis of previous ADMM that use specific surrogate functions in the MM step, but also lead to new efficient ADMM schemes. To the best of our knowledge, in the nonconvex nonsmooth setting, ADMM used in combination with the MM principle to update each block of variables, and ADMM combined with \emph{inertial terms for the primal variables} have not been studied in the literature. Under standard assumptions, we prove the subsequential convergence and global convergence for the generated sequence of iterates. We illustrate the effectiveness of iADMM on a class of nonconvex low-rank representation problems.

We present a scalable approach for learning open-world object-goal navigation (ObjectNav) -- the task of asking a virtual robot (agent) to find any instance of an object in an unexplored environment (e.g., "find a sink"). Our approach is entirely zero-shot -- i.e., it does not require ObjectNav rewards or demonstrations of any kind. Instead, we train on the image-goal navigation (ImageNav) task, in which agents find the location where a picture (i.e., goal image) was captured. Specifically, we encode goal images into a multimodal, semantic embedding space to enable training semantic-goal navigation (SemanticNav) agents at scale in unannotated 3D environments (e.g., HM3D). After training, SemanticNav agents can be instructed to find objects described in free-form natural language (e.g., "sink", "bathroom sink", etc.) by projecting language goals into the same multimodal, semantic embedding space. As a result, our approach enables open-world ObjectNav. We extensively evaluate our agents on three ObjectNav datasets (Gibson, HM3D, and MP3D) and observe absolute improvements in success of 4.2% - 20.0% over existing zero-shot methods. For reference, these gains are similar or better than the 5% improvement in success between the Habitat 2020 and 2021 ObjectNav challenge winners. In an open-world setting, we discover that our agents can generalize to compound instructions with a room explicitly mentioned (e.g., "Find a kitchen sink") and when the target room can be inferred (e.g., "Find a sink and a stove").

In recent years, a lot of attention is paid to deep learning methods in the context of vision-based construction site safety systems, especially regarding personal protective equipment. However, despite all this attention, there is still no reliable way to establish the relationship between workers and their hard hats. To answer this problem a combination of deep learning, object detection and head keypoint localization, with simple rule-based reasoning is proposed in this article. In tests, this solution surpassed the previous methods based on the relative bounding box position of different instances, as well as direct detection of hard hat wearers and non-wearers. The results show that the conjunction of novel deep learning methods with humanly-interpretable rule-based systems can result in a solution that is both reliable and can successfully mimic manual, on-site supervision. This work is the next step in the development of fully autonomous construction site safety systems and shows that there is still room for improvement in this area.

We tackle the problem of estimating the mixing time of a Markov chain from a single trajectory of observations. In contrast with previous works which considered Hilbert space methods to estimate spectral gaps, we opt for an approach based on contraction with respect to total variation. Specifically, we define and estimate a generalized contraction coefficient based on Dobrushin's. We show that this quantity -- unlike the spectral gap -- controls the mixing time up to strong universal constants and remains valid for non-reversible chains. We design fully data-dependent confidence intervals around the coefficient, which are both easier to compute and thinner than their spectral counterparts. Furthermore, we initiate the beyond worst-case analysis, by showing how to leverage additional information about the transition matrix in order to obtain instance-dependent rates for its estimation with respect to the induced uniform norm, as well as some of its mixing properties.

As more and more autonomous vehicles (AVs) are being deployed on public roads, designing socially compatible behaviors for them is becoming increasingly important. In order to generate safe and efficient actions, AVs need to not only predict the future behaviors of other traffic participants, but also be aware of the uncertainties associated with such behavior prediction. In this paper, we propose an uncertain-aware integrated prediction and planning (UAPP) framework. It allows the AVs to infer the characteristics of other road users online and generate behaviors optimizing not only their own rewards, but also their courtesy to others, and their confidence regarding the prediction uncertainties. We first propose the definitions for courtesy and confidence. Based on that, their influences on the behaviors of AVs in interactive driving scenarios are explored. Moreover, we evaluate the proposed algorithm on naturalistic human driving data by comparing the generated behavior against ground truth. Results show that the online inference can significantly improve the human-likeness of the generated behaviors. Furthermore, we find that human drivers show great courtesy to others, even for those without right-of-way. We also find that such driving preferences vary significantly in different cultures.

The construction of most supervised learning datasets revolves around collecting multiple labels for each instance, then aggregating the labels to form a type of ``gold-standard.''. We question the wisdom of this pipeline by developing a (stylized) theoretical model of this process and analyzing its statistical consequences, showing how access to non-aggregated label information can make training well-calibrated models easier or -- in some cases -- even feasible, whereas it is impossible with only gold-standard labels. The entire story, however, is subtle, and the contrasts between aggregated and fuller label information depend on the particulars of the problem, where estimators that use aggregated information exhibit robust but slower rates of convergence, while estimators that can effectively leverage all labels converge more quickly if they have fidelity to (or can learn) the true labeling process. The theory we develop in the stylized model makes several predictions for real-world datasets, including when non-aggregate labels should improve learning performance, which we test to corroborate the validity of our predictions.

Most machine learning (ML) algorithms have several stochastic elements, and their performances are affected by these sources of randomness. This paper uses an empirical study to systematically examine the effects of two sources: randomness in model training and randomness in the partitioning of a dataset into training and test subsets. We quantify and compare the magnitude of the variation in predictive performance for the following ML algorithms: Random Forests (RFs), Gradient Boosting Machines (GBMs), and Feedforward Neural Networks (FFNNs). Among the different algorithms, randomness in model training causes larger variation for FFNNs compared to tree-based methods. This is to be expected as FFNNs have more stochastic elements that are part of their model initialization and training. We also found that random splitting of datasets leads to higher variation compared to the inherent randomness from model training. The variation from data splitting can be a major issue if the original dataset has considerable heterogeneity. Keywords: Model Training, Reproducibility, Variation

Efficient algorithms to generate candidate crystal structures with good stability properties can play a key role in data-driven materials discovery. Here we show that a crystal diffusion variational autoencoder (CDVAE) is capable of generating two-dimensional (2D) materials of high chemical and structural diversity and formation energies mirroring the training structures. Specifically, we train the CDVAE on 2615 2D materials with energy above the convex hull $\Delta H_{\mathrm{hull}}< 0.3$ eV/atom, and generate 5003 materials that we relax using density functional theory (DFT). We also generate 14192 new crystals by systematic element substitution of the training structures. We find that the generative model and lattice decoration approach are complementary and yield materials with similar stability properties but very different crystal structures and chemical compositions. In total we find 11630 predicted new 2D materials, where 8599 of these have $\Delta H_{\mathrm{hull}}< 0.3$ eV/atom as the seed structures, while 2004 are within 50 meV of the convex hull and could potentially be synthesized. The relaxed atomic structures of all the materials are available in the open Computational 2D Materials Database (C2DB). Our work establishes the CDVAE as an efficient and reliable crystal generation machine, and significantly expands the space of 2D materials.

Permutation invariant neural networks are a promising tool for making predictions from sets. However, we show that existing permutation invariant architectures, Deep Sets and Set Transformer, can suffer from vanishing or exploding gradients when they are deep. Additionally, layer norm, the normalization of choice in Set Transformer, can hurt performance by removing information useful for prediction. To address these issues, we introduce the clean path principle for equivariant residual connections and develop set norm, a normalization tailored for sets. With these, we build Deep Sets++ and Set Transformer++, models that reach high depths with comparable or better performance than their original counterparts on a diverse suite of tasks. We additionally introduce Flow-RBC, a new single-cell dataset and real-world application of permutation invariant prediction. We open-source our data and code here: https://github.com/rajesh-lab/deep_permutation_invariant.

This paper proposes a physically consistent Gaussian Process (GP) enabling the identification of uncertain Lagrangian systems. The function space is tailored according to the energy components of the Lagrangian and the differential equation structure, analytically guaranteeing physical and mathematical properties such as energy conservation and quadratic form. The novel formulation of Cholesky decomposed matrix kernels allow the probabilistic preservation of positive definiteness. Only differential input-to-output measurements of the function map are required while Gaussian noise is permitted in torques, velocities, and accelerations. We demonstrate the effectiveness of the approach in numerical simulation.

Breast cancer is the most common cancers and early detection from mammography screening is crucial in improving patient outcomes. Assessing mammographic breast density is clinically important as the denser breasts have higher risk and are more likely to occlude tumors. Manual assessment by experts is both time-consuming and subject to inter-rater variability. As such, there has been increased interest in the development of deep learning methods for mammographic breast density assessment. Despite deep learning having demonstrated impressive performance in several prediction tasks for applications in mammography, clinical deployment of deep learning systems in still relatively rare; historically, mammography Computer-Aided Diagnoses (CAD) have over-promised and failed to deliver. This is in part due to the inability to intuitively quantify uncertainty of the algorithm for the clinician, which would greatly enhance usability. Conformal prediction is well suited to increase reliably and trust in deep learning tools but they lack realistic evaluations on medical datasets. In this paper, we present a detailed analysis of three possible applications of conformal prediction applied to medical imaging tasks: distribution shift characterization, prediction quality improvement, and subgroup fairness analysis. Our results show the potential of distribution-free uncertainty quantification techniques to enhance trust on AI algorithms and expedite their translation to usage.

Real-world competitive games, such as chess, go, or StarCraft II, rely on Elo models to measure the strength of their players. Since these games are not fully transitive, using Elo implicitly assumes they have a strong transitive component that can correctly be identified and extracted. In this study, we investigate the challenge of identifying the strength of the transitive component in games. First, we show that Elo models can fail to extract this transitive component, even in elementary transitive games. Then, based on this observation, we propose an extension of the Elo score: we end up with a disc ranking system that assigns each player two scores, which we refer to as skill and consistency. Finally, we propose an empirical validation on payoff matrices coming from real-world games played by bots and humans.

In modern deep learning, there is a recent and growing literature on the interplay between large-width asymptotic properties of deep Gaussian neural networks (NNs), i.e. deep NNs with Gaussian-distributed weights, and Gaussian stochastic processes (SPs). Such an interplay has proved to be critical in Bayesian inference under Gaussian SP priors, kernel regression for infinitely wide deep NNs trained via gradient descent, and information propagation within infinitely wide NNs. Motivated by empirical analyses that show the potential of replacing Gaussian distributions with Stable distributions for the NN's weights, in this paper we present a rigorous analysis of the large-width asymptotic behaviour of (fully connected) feed-forward deep Stable NNs, i.e. deep NNs with Stable-distributed weights. We show that as the width goes to infinity jointly over the NN's layers, i.e. the ``joint growth" setting, a rescaled deep Stable NN converges weakly to a Stable SP whose distribution is characterized recursively through the NN's layers. Because of the non-triangular structure of the NN, this is a non-standard asymptotic problem, to which we propose an inductive approach of independent interest. Then, we establish sup-norm convergence rates of the rescaled deep Stable NN to the Stable SP, under the ``joint growth" and a ``sequential growth" of the width over the NN's layers. Such a result provides the difference between the ``joint growth" and the ``sequential growth" settings, showing that the former leads to a slower rate than the latter, depending on the depth of the layer and the number of inputs of the NN. Our work extends some recent results on infinitely wide limits for deep Gaussian NNs to the more general deep Stable NNs, providing the first result on convergence rates in the ``joint growth" setting.

Using Machine Learning systems in the real world can often be problematic, with inexplicable black-box models, the assumed certainty of imperfect measurements, or providing a single classification instead of a probability distribution. This paper introduces Indecision Trees, a modification to Decision Trees which learn under uncertainty, can perform inference under uncertainty, provide a robust distribution over the possible labels, and can be disassembled into a set of logical arguments for use in other reasoning systems.

In this paper, we investigate the content popularity prediction problem in cache-enabled fog radio access networks (F-RANs). In order to predict the content popularity with high accuracy and low complexity, we propose a Gaussian process based regressor to model the content request pattern. Firstly, the relationship between content features and popularity is captured by our proposed model. Then, we utilize Bayesian learning to train the model parameters, which is robust to overfitting. However, Bayesian methods are usually unable to find a closed-form expression of the posterior distribution. To tackle this issue, we apply a stochastic variance reduced gradient Hamiltonian Monte Carlo (SVRG-HMC) method to approximate the posterior distribution. To utilize the computing resources of other fog access points (F-APs) and to reduce the communications overhead, we propose a quantized federated learning (FL) framework combining with Bayesian learning. The quantized federated Bayesian learning framework allows each F-AP to send gradients to the cloud server after quantizing and encoding. It can achieve a tradeoff between prediction accuracy and communications overhead effectively. Simulation results show that the performance of our proposed policy outperforms the existing policies.

The recent text-to-speech (TTS) has achieved quality comparable to that of humans; however, its application in spoken dialogue has not been widely studied. This study aims to realize a TTS that closely resembles human dialogue. First, we record and transcribe actual spontaneous dialogues. Then, the proposed dialogue TTS is trained in two stages: first stage, variational autoencoder (VAE)-VITS or Gaussian mixture variational autoencoder (GMVAE)-VITS is trained, which introduces an utterance-level latent variable into variational inference with adversarial learning for end-to-end text-to-speech (VITS), a recently proposed end-to-end TTS model. A style encoder that extracts a latent speaking style representation from speech is trained jointly with TTS. In the second stage, a style predictor is trained to predict the speaking style to be synthesized from dialogue history. During inference, by passing the speaking style representation predicted by the style predictor to VAE/GMVAE-VITS, speech can be synthesized in a style appropriate to the context of the dialogue. Subjective evaluation results demonstrate that the proposed method outperforms the original VITS in terms of dialogue-level naturalness.

Modifying standard gradient boosting by replacing the embedded weak learner in favor of a strong(er) one, we present SyRBo: Symbolic-Regression Boosting. Experiments over 98 regression datasets show that by adding a small number of boosting stages -- between 2--5 -- to a symbolic regressor, statistically significant improvements can often be attained. We note that coding SyRBo on top of any symbolic regressor is straightforward, and the added cost is simply a few more evolutionary rounds. SyRBo is essentially a simple add-on that can be readily added to an extant symbolic regressor, often with beneficial results.

Sound source localization aims to seek the direction of arrival (DOA) of all sound sources from the observed multi-channel audio. For the practical problem of unknown number of sources, existing localization algorithms attempt to predict a likelihood-based coding (i.e., spatial spectrum) and employ a pre-determined threshold to detect the source number and corresponding DOA value. However, these threshold-based algorithms are not stable since they are limited by the careful choice of threshold. To address this problem, we propose an iterative sound source localization approach called ISSL, which can iteratively extract each source's DOA without threshold until the termination criterion is met. Unlike threshold-based algorithms, ISSL designs an active source detector network based on binary classifier to accept residual spatial spectrum and decide whether to stop the iteration. By doing so, our ISSL can deal with an arbitrary number of sources, even more than the number of sources seen during the training stage. The experimental results show that our ISSL achieves significant performance improvements in both DOA estimation and source number detection compared with the existing threshold-based algorithms.

We show that any matrix product state (MPS) can be exactly represented by a recurrent neural network (RNN) with a linear memory update. We generalize this RNN architecture to 2D lattices using a multilinear memory update. It supports perfect sampling and wave function evaluation in polynomial time, and can represent an area law of entanglement entropy. Numerical evidence shows that it can encode the wave function using a bond dimension lower by orders of magnitude when compared to MPS, with an accuracy that can be systematically improved by increasing the bond dimension.

Differentiable architecture search (DARTS) is an effective method for data-driven neural network design based on solving a bilevel optimization problem. Despite its success in many architecture search tasks, there are still some concerns about the accuracy of first-order DARTS and the efficiency of the second-order DARTS. In this paper, we formulate a single level alternative and a relaxed architecture search (RARTS) method that utilizes the whole dataset in architecture learning via both data and network splitting, without involving mixed second derivatives of the corresponding loss functions like DARTS. In our formulation of network splitting, two networks with different but related weights cooperate in search of a shared architecture. The advantage of RARTS over DARTS is justified by a convergence theorem and an analytically solvable model. Moreover, RARTS outperforms DARTS and its variants in accuracy and search efficiency, as shown in adequate experimental results. For the task of searching topological architecture, i.e., the edges and the operations, RARTS obtains a higher accuracy and 60\% reduction of computational cost than second-order DARTS on CIFAR-10. RARTS continues to out-perform DARTS upon transfer to ImageNet and is on par with recent variants of DARTS even though our innovation is purely on the training algorithm without modifying search space. For the task of searching width, i.e., the number of channels in convolutional layers, RARTS also outperforms the traditional network pruning benchmarks. Further experiments on the public architecture search benchmark like NATS-Bench also support the preeminence of RARTS.

The growing volumes of data being collected and its analysis to provide better services are creating worries about digital privacy. To address privacy concerns and give practical solutions, the literature has relied on secure multiparty computation. However, recent research has mostly focused on the small-party honest-majority setting of up to four parties, noting efficiency concerns. In this work, we extend the strategies to support a larger number of participants in an honest-majority setting with efficiency at the center stage. Cast in the preprocessing paradigm, our semi-honest protocol improves the online complexity of the decade-old state-of-the-art protocol of Damg\aa rd and Nielson (CRYPTO'07). In addition to having an improved online communication cost, we can shut down almost half of the parties in the online phase, thereby saving up to 50% in the system's operational costs. Our maliciously secure protocol also enjoys similar benefits and requires only half of the parties, except for one-time verification, towards the end. To showcase the practicality of the designed protocols, we benchmark popular applications such as deep neural networks, graph neural networks, genome sequence matching, and biometric matching using prototype implementations. Our improved protocols aid in bringing up to 60-80% savings in monetary cost over prior work.

This paper studies the joint community detection and phase synchronization problem on the \textit{stochastic block model with relative phase}, where each node is associated with a phase. This problem, with a variety of real-world applications, aims to recover community memberships and associated phases simultaneously. By studying the maximum likelihood estimation formulation, we show that this problem exhibits a \textit{``multi-frequency''} structure. To this end, two simple yet efficient algorithms that leverage information across multiple frequencies are proposed. The former is a spectral method based on the novel multi-frequency column-pivoted QR factorization, and the latter is an iterative multi-frequency generalized power method. Numerical experiments indicate our proposed algorithms outperform state-of-the-art algorithms, in recovering community memberships and associated phases.

Neural networks have been widely applied in security applications such as spam and phishing detection, intrusion prevention, and malware detection. This black-box method, however, often has uncertainty and poor explainability in applications. Furthermore, neural networks themselves are often vulnerable to adversarial attacks. For those reasons, there is a high demand for trustworthy and rigorous methods to verify the robustness of neural network models. Adversarial robustness, which concerns the reliability of a neural network when dealing with maliciously manipulated inputs, is one of the hottest topics in security and machine learning. In this work, we survey existing literature in adversarial robustness verification for neural networks and collect 39 diversified research works across machine learning, security, and software engineering domains. We systematically analyze their approaches, including how robustness is formulated, what verification techniques are used, and the strengths and limitations of each technique. We provide a taxonomy from a formal verification perspective for a comprehensive understanding of this topic. We classify the existing techniques based on property specification, problem reduction, and reasoning strategies. We also demonstrate representative techniques that have been applied in existing studies with a sample model. Finally, we discuss open questions for future research.

Deep learning models are able to approximate one specific dynamical system but struggle at learning generalisable dynamics, where dynamical systems obey the same laws of physics but contain different numbers of elements (e.g., double- and triple-pendulum systems). To relieve this issue, we proposed the Modular Lagrangian Network (ModLaNet), a structural neural network framework with modularity and physical inductive bias. This framework models the energy of each element using modularity and then construct the target dynamical system via Lagrangian mechanics. Modularity is beneficial for reusing trained networks and reducing the scale of networks and datasets. As a result, our framework can learn from the dynamics of simpler systems and extend to more complex ones, which is not feasible using other relevant physics-informed neural networks. We examine our framework for modelling double-pendulum or three-body systems with small training datasets, where our models achieve the best data efficiency and accuracy performance compared with counterparts. We also reorganise our models as extensions to model multi-pendulum and multi-body systems, demonstrating the intriguing reusable feature of our framework.

Geometrical shape of airfoils, together with the corresponding flight conditions, are crucial factors for aerodynamic performances prediction. The obtained airfoils geometrical features in most existing approaches (e.g., geometrical parameters extraction, polynomial description and deep learning) are in Euclidean space. State-of-the-art studies showed that curves or surfaces of an airfoil formed a manifold in Riemannian space. Therefore, the features extracted by existing methods are not sufficient to reflect the geometric-features of airfoils. Meanwhile, flight conditions and geometric features are greatly discrepant with different types, the relevant knowledge of the influence of these two factors that on final aerodynamic performances predictions must be evaluated and learned to improve prediction accuracy. Motivated by the advantages of manifold theory and multi-task learning, we propose a manifold-based airfoil geometric-feature extraction and discrepant data fusion learning method (MDF) to extract geometric-features of airfoils in Riemannian space (we call them manifold-features) and further fuse the manifold-features with flight conditions to predict aerodynamic performances. Experimental results show that our method could extract geometric-features of airfoils more accurately compared with existing methods, that the average MSE of re-built airfoils is reduced by 56.33%, and while keeping the same predicted accuracy level of CL, the MSE of CD predicted by MDF is further reduced by 35.37%.

Privacy-preserving federated learning allows multiple users to jointly train a model with coordination of a central server. The server only learns the final aggregation result, thereby preventing leakage of the users' (private) training data from the individual model updates. However, keeping the individual updates private allows malicious users to perform Byzantine attacks and degrade the model accuracy without being detected. Best existing defenses against Byzantine workers rely on robust rank-based statistics, e.g., the median, to find malicious updates. However, implementing privacy-preserving rank-based statistics is nontrivial and unscalable in the secure domain, as it requires sorting of all individual updates. We establish the first private robustness check that uses high break point rank-based statistics on aggregated model updates. By exploiting randomized clustering, we significantly improve the scalability of our defense without compromising privacy. We leverage the derived statistical bounds in zero-knowledge proofs to detect and remove malicious updates without revealing the private user updates. Our novel framework, zPROBE, enables Byzantine resilient and secure federated learning. Empirical evaluations demonstrate that zPROBE provides a low overhead solution to defend against state-of-the-art Byzantine attacks while preserving privacy.

Adversarial training (AT) has shown excellent high performance in defending against adversarial examples. Recent studies demonstrate that examples are not equally important to the final robustness of models during AT, that is, the so-called hard examples that can be attacked easily exhibit more influence than robust examples on the final robustness. Therefore, guaranteeing the robustness of hard examples is crucial for improving the final robustness of the model. However, defining effective heuristics to search for hard examples is still difficult. In this article, inspired by the information bottleneck (IB) principle, we uncover that an example with high mutual information of the input and its associated latent representation is more likely to be attacked. Based on this observation, we propose a novel and effective adversarial training method (InfoAT). InfoAT is encouraged to find examples with high mutual information and exploit them efficiently to improve the final robustness of models. Experimental results show that InfoAT achieves the best robustness among different datasets and models in comparison with several state-of-the-art methods.

Bearings are one of the vital components of rotating machines that are prone to unexpected faults. Therefore, bearing fault diagnosis and condition monitoring is essential for reducing operational costs and downtime in numerous industries. In various production conditions, bearings can be operated under a range of loads and speeds, which causes different vibration patterns associated with each fault type. Normal data is ample as systems usually work in desired conditions. On the other hand, fault data is rare, and in many conditions, there is no data recorded for the fault classes. Accessing fault data is crucial for developing data-driven fault diagnosis tools that can improve both the performance and safety of operations. To this end, a novel algorithm based on Conditional Generative Adversarial Networks (CGANs) is introduced. Trained on the normal and fault data on any actual fault conditions, this algorithm generates fault data from normal data of target conditions. The proposed method is validated on a real-world bearing dataset, and fault data are generated for different conditions. Several state-of-the-art classifiers and visualization models are implemented to evaluate the quality of the synthesized data. The results demonstrate the efficacy of the proposed algorithm.

The prototypical approach to reinforcement learning involves training policies tailored to a particular agent from scratch for every new morphology. Recent work aims to eliminate the re-training of policies by investigating whether a morphology-agnostic policy, trained on a diverse set of agents with similar task objectives, can be transferred to new agents with unseen morphologies without re-training. This is a challenging problem that required previous approaches to use hand-designed descriptions of the new agent's morphology. Instead of hand-designing this description, we propose a data-driven method that learns a representation of morphology directly from the reinforcement learning objective. Ours is the first reinforcement learning algorithm that can train a policy to generalize to new agent morphologies without requiring a description of the agent's morphology in advance. We evaluate our approach on the standard benchmark for agent-agnostic control, and improve over the current state of the art in zero-shot generalization to new agents. Importantly, our method attains good performance without an explicit description of morphology.

We examine using data from multiple sensing modes, i.e., accelerometry and global navigation satellite system (GNSS), for classifying animal behavior. We extract three new features from the GNSS data, namely, the distance from the water point, median speed, and median estimated horizontal position error. We consider two approaches for combining the information available from the accelerometry and GNSS data. The first approach is based on concatenating the features extracted from both sensor data and feeding the concatenated feature vector into a multi-layer perceptron (MLP) classifier. The second approach is based on fusing the posterior probabilities predicted by two MLP classifiers each taking the features extracted from the data of one sensor as input. We evaluate the performance of the developed multi-modal animal behavior classification algorithms using two real-world datasets collected via smart cattle collar and ear tags. The leave-one-animal-out cross-validation results show that both approaches improve the classification performance appreciably compared with using the data from only one sensing mode, in particular, for the infrequent but important behaviors of walking and drinking. The algorithms developed based on both approaches require rather small computational and memory resources hence are suitable for implementation on embedded systems of our collar and ear tags. However, the multi-modal animal behavior classification algorithm based on posterior probability fusion is preferable to the one based on feature concatenation as it delivers better classification accuracy, has less computational and memory complexity, is more robust to sensor data failure, and enjoys better modularity.

In this paper, we provide a systematic approach for assessing and comparing the computational complexity of neural network layers in digital signal processing. We provide and link four software-to-hardware complexity measures, defining how the different complexity metrics relate to the layers' hyper-parameters. This paper explains how to compute these four metrics for feed-forward and recurrent layers, and defines in which case we ought to use a particular metric depending on whether we characterize a more soft- or hardware-oriented application. One of the four metrics, called `the number of additions and bit shifts (NABS)', is newly introduced for heterogeneous quantization. NABS characterizes the impact of not only the bitwidth used in the operation but also the type of quantization used in the arithmetical operations. We intend this work to serve as a baseline for the different levels (purposes) of complexity estimation related to the neural networks' application in real-time digital signal processing, aiming at unifying the computational complexity estimation.

Although deep neural networks (DNNs) are known to be fragile, no one has studied the effects of zooming-in and zooming-out of images in the physical world on DNNs performance. In this paper, we demonstrate a novel physical adversarial attack technique called Adversarial Zoom Lens (AdvZL), which uses a zoom lens to zoom in and out of pictures of the physical world, fooling DNNs without changing the characteristics of the target object. The proposed method is so far the only adversarial attack technique that does not add physical adversarial perturbation attack DNNs. In a digital environment, we construct a data set based on AdvZL to verify the antagonism of equal-scale enlarged images to DNNs. In the physical environment, we manipulate the zoom lens to zoom in and out of the target object, and generate adversarial samples. The experimental results demonstrate the effectiveness of AdvZL in both digital and physical environments. We further analyze the antagonism of the proposed data set to the improved DNNs. On the other hand, we provide a guideline for defense against AdvZL by means of adversarial training. Finally, we look into the threat possibilities of the proposed approach to future autonomous driving and variant attack ideas similar to the proposed attack.

For the first time, recurrent and feedforward neural network-based equalizers for nonlinearity compensation are implemented in an FPGA, with a level of complexity comparable to that of a dispersion equalizer. We demonstrate that the NN-based equalizers can outperform a 1 step-per-span DBP.

Can we inject the pocket-ligand interaction knowledge into the pre-trained model and jointly learn their chemical space? Pretraining molecules and proteins has attracted considerable attention in recent years, while most of these approaches focus on learning one of the chemical spaces and lack the injection of biological knowledge. We propose a co-supervised pretraining (CoSP) framework to simultaneously learn 3D pocket and ligand representations. We use a gated geometric message passing layer to model both 3D pockets and ligands, where each node's chemical features, geometric position and orientation are considered. To learn biological meaningful embeddings, we inject the pocket-ligand interaction knowledge into the pretraining model via contrastive loss. Considering the specificity of molecules, we further propose a chemical similarity-enhanced negative sampling strategy to improve the contrastive learning performance. Through extensive experiments, we conclude that CoSP can achieve competitive results in pocket matching, molecule property predictions, and virtual screening.

Parameter adaptation, that is the capability to automatically adjust an algorithm's hyperparameters depending on the problem being faced, is one of the main trends in evolutionary computation applied to numerical optimization. While several handcrafted adaptation policies have been proposed over the years to address this problem, only few attempts have been done so far at apply machine learning to learn such policies. Here, we introduce a general-purpose framework for performing parameter adaptation in continuous-domain metaheuristics based on state-of-the-art reinforcement learning algorithms. We demonstrate the applicability of this framework on two algorithms, namely Covariance Matrix Adaptation Evolution Strategies (CMA-ES) and Differential Evolution (DE), for which we learn, respectively, adaptation policies for the step-size (for CMA-ES), and the scale factor and crossover rate (for DE). We train these policies on a set of 46 benchmark functions at different dimensionalities, with various inputs to the policies, in two settings: one policy per function, and one global policy for all functions. Compared, respectively, to the Cumulative Step-size Adaptation (CSA) policy and to two well-known adaptive DE variants (iDE and jDE), our policies are able to produce competitive results in the majority of cases, especially in the case of DE.

We propose world value functions (WVFs), a type of goal-oriented general value function that represents how to solve not just a given task, but any other goal-reaching task in an agent's environment. This is achieved by equipping an agent with an internal goal space defined as all the world states where it experiences a terminal transition. The agent can then modify the standard task rewards to define its own reward function, which provably drives it to learn how to achieve all reachable internal goals, and the value of doing so in the current task. We demonstrate two key benefits of WVFs in the context of learning and planning. In particular, given a learned WVF, an agent can compute the optimal policy in a new task by simply estimating the task's reward function. Furthermore, we show that WVFs also implicitly encode the transition dynamics of the environment, and so can be used to perform planning. Experimental results show that WVFs can be learned faster than regular value functions, while their ability to infer the environment's dynamics can be used to integrate learning and planning methods to further improve sample efficiency.

Origin-Destination Estimation plays an important role in traffic management and traffic simulation in the era of Intelligent Transportation System (ITS). Nevertheless, previous model-based methods face the under-determined challenge, thus desperate demand for additional assumptions and extra data exists. Deep learning provides an ideal data-based method for connecting inputs and outputs by probabilistic distribution transformation. While relevant researches of applying deep learning into OD estimation are limited due to the challenges lying in data transformation across representation space, especially from dynamic spatial-temporal space to heterogeneous graph in this issue. To address it, we propose Cyclic Graph Attentive Matching Encoder (C-GAME) based on a novel Graph Matcher with double-layer attention mechanism. It realizes effective information exchange and establishes coupling relationship across underlying feature space. The proposed model achieves state-of-the-art results in experiments, and offers a novel framework for inference task across spaces in prospective employments.

Healthcare providers usually record detailed notes of the clinical care delivered to each patient for clinical, research, and billing purposes. Due to the unstructured nature of these narratives, providers employ dedicated staff to assign diagnostic codes to patients' diagnoses using the International Classification of Diseases (ICD) coding system. This manual process is not only time-consuming but also costly and error-prone. Prior work demonstrated potential utility of Machine Learning (ML) methodology in automating this process, but it has relied on large quantities of manually labeled data to train the models. Additionally, diagnostic coding systems evolve with time, which makes traditional supervised learning strategies unable to generalize beyond local applications. In this work, we introduce a general weakly-supervised text classification framework that learns from class-label descriptions only, without the need to use any human-labeled documents. It leverages the linguistic domain knowledge stored within pre-trained language models and the data programming framework to assign code labels to individual texts. We demonstrate the efficacy and flexibility of our method by comparing it to state-of-the-art weak text classifiers across four real-world text classification datasets, in addition to assigning ICD codes to medical notes in the publicly available MIMIC-III database.

Continual learning approaches help deep neural network models adapt and learn incrementally by trying to solve catastrophic forgetting. However, whether these existing approaches, applied traditionally to image-based tasks, work with the same efficacy to the sequential time series data generated by mobile or embedded sensing systems remains an unanswered question. To address this void, we conduct the first comprehensive empirical study that quantifies the performance of three predominant continual learning schemes (i.e., regularization, replay, and replay with examples) on six datasets from three mobile and embedded sensing applications in a range of scenarios having different learning complexities. More specifically, we implement an end-to-end continual learning framework on edge devices. Then we investigate the generalizability, trade-offs between performance, storage, computational costs, and memory footprint of different continual learning methods. Our findings suggest that replay with exemplars-based schemes such as iCaRL has the best performance trade-offs, even in complex scenarios, at the expense of some storage space (few MBs) for training examples (1% to 5%). We also demonstrate for the first time that it is feasible and practical to run continual learning on-device with a limited memory budget. In particular, the latency on two types of mobile and embedded devices suggests that both incremental learning time (few seconds - 4 minutes) and training time (1 - 75 minutes) across datasets are acceptable, as training could happen on the device when the embedded device is charging thereby ensuring complete data privacy. Finally, we present some guidelines for practitioners who want to apply a continual learning paradigm for mobile sensing tasks.

Optimal transport (OT) is known to be sensitive against outliers because of its marginal constraints. Outlier robust OT variants have been proposed based on the definition that outliers are samples which are expensive to move. In this paper, we show that this definition is restricted by considering the case where outliers are closer to the target measure than clean samples. We show that outlier robust OT fully transports these outliers leading to poor performances in practice. To tackle these outliers, we propose to detect them by relying on a classifier trained with adversarial training to classify source and target samples. A sample is then considered as an outlier if the prediction from the classifier is different from its assigned label. To decrease the influence of these outliers in the transport problem, we propose to either remove them from the problem or to increase the cost of moving them by using the classifier prediction. We show that we successfully detect these outliers and that they do not influence the transport problem on several experiments such as gradient flows, generative models and label propagation.

Linear time-invariant state space models (SSM) are a classical model from engineering and statistics, that have recently been shown to be very promising in machine learning through the Structured State Space sequence model (S4). A core component of S4 involves initializing the SSM state matrix to a particular matrix called a HiPPO matrix, which was empirically important for S4's ability to handle long sequences. However, the specific matrix that S4 uses was actually derived in previous work for a particular time-varying dynamical system, and the use of this matrix as a time-invariant SSM had no known mathematical interpretation. Consequently, the theoretical mechanism by which S4 models long-range dependencies actually remains unexplained. We derive a more general and intuitive formulation of the HiPPO framework, which provides a simple mathematical interpretation of S4 as a decomposition onto exponentially-warped Legendre polynomials, explaining its ability to capture long dependencies. Our generalization introduces a theoretically rich class of SSMs that also lets us derive more intuitive S4 variants for other bases such as the Fourier basis, and explains other aspects of training S4, such as how to initialize the important timescale parameter. These insights improve S4's performance to 86% on the Long Range Arena benchmark, with 96% on the most difficult Path-X task.

Deep learning has proven to be a very effective approach for Hyperspectral Image (HSI) classification. However, deep neural networks require large annotated datasets to generalize well. This limits the applicability of deep learning for HSI classification, where manually labelling thousands of pixels for every scene is impractical. In this paper, we propose to leverage Self Supervised Learning (SSL) for HSI classification. We show that by pre-training an encoder on unlabeled pixels using Barlow-Twins, a state-of-the-art SSL algorithm, we can obtain accurate models with a handful of labels. Experimental results demonstrate that this approach significantly outperforms vanilla supervised learning.

With the deployment of the fifth generation (5G) wireless systems gathering momentum across the world, possible technologies for 6G are under active research discussions. In particular, the role of machine learning (ML) in 6G is expected to enhance and aid emerging applications such as virtual and augmented reality, vehicular autonomy, and computer vision. This will result in large segments of wireless data traffic comprising image, video and speech. The ML algorithms process these for classification/recognition/estimation through the learning models located on cloud servers. This requires wireless transmission of data from edge devices to the cloud server. Channel estimation, handled separately from recognition step, is critical for accurate learning performance. Toward combining the learning for both channel and the ML data, we introduce implicit channel learning to perform the ML tasks without estimating the wireless channel. Here, the ML models are trained with channel-corrupted datasets in place of nominal data. Without channel estimation, the proposed approach exhibits approximately 60% improvement in image and speech classification tasks for diverse scenarios such as millimeter wave and IEEE 802.11p vehicular channels.

Various deep learning models, especially some latest Transformer-based approaches, have greatly improved the state-of-art performance for long-term time series forecasting.However, those transformer-based models suffer a severe deterioration performance with prolonged input length, which prohibits them from using extended historical info.Moreover, these methods tend to handle complex examples in long-term forecasting with increased model complexity, which often leads to a significant increase in computation and less robustness in performance(e.g., overfitting). We propose a novel neural network architecture, called TreeDRNet, for more effective long-term forecasting. Inspired by robust regression, we introduce doubly residual link structure to make prediction more robust.Built upon Kolmogorov-Arnold representation theorem, we explicitly introduce feature selection, model ensemble, and a tree structure to further utilize the extended input sequence, which improves the robustness and representation power of TreeDRNet. Unlike previous deep models for sequential forecasting work, TreeDRNet is built entirely on multilayer perceptron and thus enjoys high computational efficiency. Our extensive empirical studies show that TreeDRNet is significantly more effective than state-of-the-art methods, reducing prediction errors by 20% to 40% for multivariate time series. In particular, TreeDRNet is over 10 times more efficient than transformer-based methods. The code will be released soon.

Graph Neural Networks (GNNs) have shown satisfying performance in various graph analytical problems. Hence, they have become the \emph{de facto} solution in a variety of decision-making scenarios. However, GNNs could yield biased results against certain demographic subgroups. Some recent works have empirically shown that the biased structure of the input network is a significant source of bias for GNNs. Nevertheless, no studies have systematically scrutinized which part of the input network structure leads to biased predictions for any given node. The low transparency on how the structure of the input network influences the bias in GNN outcome largely limits the safe adoption of GNNs in various decision-critical scenarios. In this paper, we study a novel research problem of structural explanation of bias in GNNs. Specifically, we propose a novel post-hoc explanation framework to identify two edge sets that can maximally account for the exhibited bias and maximally contribute to the fairness level of the GNN prediction for any given node, respectively. Such explanations not only provide a comprehensive understanding of bias/fairness of GNN predictions but also have practical significance in building an effective yet fair GNN model. Extensive experiments on real-world datasets validate the effectiveness of the proposed framework towards delivering effective structural explanations for the bias of GNNs. Open-source code can be found at https://github.com/yushundong/REFEREE.

Federated learning is an emerging concept in the domain of distributed machine learning. This concept has enabled GANs to benefit from the rich distributed training data while preserving privacy. However, in a non-iid setting, current federated GAN architectures are unstable, struggling to learn the distinct features and vulnerable to mode collapse. In this paper, we propose a novel architecture MULTI-FLGAN to solve the problem of low-quality images, mode collapse and instability for non-iid datasets. Our results show that MULTI-FLGAN is four times as stable and performant (i.e. high inception score) on average over 20 clients compared to baseline FLGAN.

Knowledge distillation in machine learning is the process of transferring knowledge from a large model called the teacher to a smaller model called the student. Knowledge distillation is one of the techniques to compress the large network (teacher) to a smaller network (student) that can be deployed in small devices such as mobile phones. When the network size gap between the teacher and student increases, the performance of the student network decreases. To solve this problem, an intermediate model is employed between the teacher model and the student model known as the teaching assistant model, which in turn bridges the gap between the teacher and the student. In this research, we have shown that using multiple teaching assistant models, the student model (the smaller model) can be further improved. We combined these multiple teaching assistant models using weighted ensemble learning where we have used a differential evaluation optimization algorithm to generate the weight values.

Aggregate data often appear in various fields such as socio-economics and public security. The aggregate data are associated not with points but with supports (e.g., spatial regions in a city). Since the supports may have various granularities depending on attributes (e.g., poverty rate and crime rate), modeling such data is not straightforward. This article offers a multi-output Gaussian process (MoGP) model that infers functions for attributes using multiple aggregate datasets of respective granularities. In the proposed model, the function for each attribute is assumed to be a dependent GP modeled as a linear mixing of independent latent GPs. We design an observation model with an aggregation process for each attribute; the process is an integral of the GP over the corresponding support. We also introduce a prior distribution of the mixing weights, which allows a knowledge transfer across domains (e.g., cities) by sharing the prior. This is advantageous in such a situation where the spatially aggregated dataset in a city is too coarse to interpolate; the proposed model can still make accurate predictions of attributes by utilizing aggregate datasets in other cities. The inference of the proposed model is based on variational Bayes, which enables one to learn the model parameters using the aggregate datasets from multiple domains. The experiments demonstrate that the proposed model outperforms in the task of refining coarse-grained aggregate data on real-world datasets: Time series of air pollutants in Beijing and various kinds of spatial datasets from New York City and Chicago.

We describe a general approach to smoothing and mapping with a class of discrete-continuous factor graphs commonly encountered in robotics applications. While there are openly available tools providing flexible and easy-to-use interfaces for specifying and solving optimization problems formulated in terms of either discrete or continuous graphical models, at present, no similarly general tools exist enabling the same functionality for hybrid discrete-continuous problems. We aim to address this problem. In particular, we provide a library, DC-SAM, extending existing tools for optimization problems defined in terms of factor graphs to the setting of discrete-continuous models. A key contribution of our work is a novel solver for efficiently recovering approximate solutions to discrete-continuous optimization problems. The key insight to our approach is that while joint inference over continuous and discrete state spaces is often hard, many commonly encountered discrete-continuous problems can naturally be split into a "discrete part" and a "continuous part" that can individually be solved easily. Leveraging this structure, we optimize discrete and continuous variables in an alternating fashion. In consequence, our proposed work enables straightforward representation of and approximate inference in discrete-continuous graphical models. We also provide a method to recover the uncertainty in estimates of both discrete and continuous variables. We demonstrate the versatility of our approach through its application to three distinct robot perception applications: point-cloud registration, robust pose graph optimization, and object-based mapping and localization.

Predicting the output of quantum circuits is a hard computational task that plays a pivotal role in the development of universal quantum computers. Here we investigate the supervised learning of output expectation values of random quantum circuits. Deep convolutional neural networks (CNNs) are trained to predict single-qubit and two-qubit expectation values using databases of classically simulated circuits. These circuits are represented via an appropriately designed one-hot encoding of the constituent gates. The prediction accuracy for previously unseen circuits is analyzed, also making comparisons with small-scale quantum computers available from the free IBM Quantum program. The CNNs often outperform the quantum devices, depending on the circuit depth, on the network depth, and on the training set size. Notably, our CNNs are designed to be scalable. This allows us exploiting transfer learning and performing extrapolations to circuits larger than those included in the training set. These CNNs also demonstrate remarkable resilience against noise, namely, they remain accurate even when trained on (simulated) expectation values averaged over very few measurements.

Fairness across different demographic groups is an essential criterion for face-related tasks, Face Attribute Classification (FAC) being a prominent example. Apart from this trend, Federated Learning (FL) is increasingly gaining traction as a scalable paradigm for distributed training. Existing FL approaches require data homogeneity to ensure fairness. However, this assumption is too restrictive in real-world settings. We propose F3, a novel FL framework for fair FAC under data heterogeneity. F3 adopts multiple heuristics to improve fairness across different demographic groups without requiring data homogeneity assumption. We demonstrate the efficacy of F3 by reporting empirically observed fairness measures and accuracy guarantees on popular face datasets. Our results suggest that F3 strikes a practical balance between accuracy and fairness for FAC.

Training deep neural networks is a well-known highly non-convex problem. In recent works, it is shown that there is no duality gap for regularized two-layer neural networks with ReLU activation, which enables global optimization via convex programs. For multi-layer linear networks with vector outputs, we formulate convex dual problems and demonstrate that the duality gap is non-zero for depth three and deeper networks. However, by modifying the deep networks to more powerful parallel architectures, we show that the duality gap is exactly zero. Therefore, strong convex duality holds, and hence there exist equivalent convex programs that enable training deep networks to global optimality. We also demonstrate that the weight decay regularization in the parameters explicitly encourages low-rank solutions via closed-form expressions. For three-layer non-parallel ReLU networks, we show that strong duality holds for rank-1 data matrices, however, the duality gap is non-zero for whitened data matrices. Similarly, by transforming the neural network architecture into a corresponding parallel version, the duality gap vanishes.

In nuclear imaging, limited resolution causes partial volume effects (PVEs) that affect image sharpness and quantitative accuracy. Partial volume correction (PVC) methods incorporating high-resolution anatomical information from CT or MRI have been demonstrated to be effective. However, such anatomical-guided methods typically require tedious image registration and segmentation steps. Accurately segmented organ templates are also hard to obtain, particularly in cardiac SPECT imaging, due to the lack of hybrid SPECT/CT scanners with high-end CT and associated motion artifacts. Slight mis-registration/mis-segmentation would result in severe degradation in image quality after PVC. In this work, we develop a deep-learning-based method for fast cardiac SPECT PVC without anatomical information and associated organ segmentation. The proposed network involves a densely-connected multi-dimensional dynamic mechanism, allowing the convolutional kernels to be adapted based on the input images, even after the network is fully trained. Intramyocardial blood volume (IMBV) is introduced as an additional clinical-relevant loss function for network optimization. The proposed network demonstrated promising performance on 28 canine studies acquired on a GE Discovery NM/CT 570c dedicated cardiac SPECT scanner with a 64-slice CT using Technetium-99m-labeled red blood cells. This work showed that the proposed network with densely-connected dynamic mechanism produced superior results compared with the same network without such mechanism. Results also showed that the proposed network without anatomical information could produce images with statistically comparable IMBV measurements to the images generated by anatomical-guided PVC methods, which could be helpful in clinical translation.

Tracking multiple moving objects in real-time in a dynamic threat environment is an important element in national security and surveillance system. It helps pinpoint and distinguish potential candidates posing threats from other normal objects and monitor the anomalous trajectories until intervention. To locate the anomalous pattern of movements, one needs to have an accurate data association algorithm that can associate the sequential observations of locations and motion with the underlying moving objects, and therefore, build the trajectories of the objects as the objects are moving. In this work, we develop a spatio-temporal approach for tracking maritime vessels as the vessel's location and motion observations are collected by an Automatic Identification System. The proposed approach is developed as an effort to address a data association challenge in which the number of vessels as well as the vessel identification are purposely withheld and time gaps are created in the datasets to mimic the real-life operational complexities under a threat environment. Three training datasets and five test sets are provided in the challenge and a set of quantitative performance metrics is devised by the data challenge organizer for evaluating and comparing resulting methods developed by participants. When our proposed track association algorithm is applied to the five test sets, the algorithm scores a very competitive performance.

Language models (LM) are becoming prevalent in many language-based application spaces globally. Although these LMs are improving our day-to-day interactions with digital products, concerns remain whether open-ended languages or text generated from these models reveal any biases toward a specific group of people, thereby risking the usability of a certain product. There is a need to identify whether these models possess bias to improve the fairness in these models. This gap motivates our ongoing work, where we measured the two aspects of bias in GPT-3 generated text through a disability lens.

Graph instance contrastive learning has been proved as an effective task for Graph Neural Network (GNN) pre-training. However, one key issue may seriously impede the representative power in existing works: Positive instances created by current methods often miss crucial information of graphs or even yield illegal instances (such as non-chemically-aware graphs in molecular generation). To remedy this issue, we propose to select positive graph instances directly from existing graphs in the training set, which ultimately maintains the legality and similarity to the target graphs. Our selection is based on certain domain-specific pair-wise similarity measurements as well as sampling from a hierarchical graph encoding similarity relations among graphs. Besides, we develop an adaptive node-level pre-training method to dynamically mask nodes to distribute them evenly in the graph. We conduct extensive experiments on $13$ graph classification and node classification benchmark datasets from various domains. The results demonstrate that the GNN models pre-trained by our strategies can outperform those trained-from-scratch models as well as the variants obtained by existing methods.

We study reinforcement learning with function approximation for large-scale Partially Observable Markov Decision Processes (POMDPs) where the state space and observation space are large or even continuous. Particularly, we consider Hilbert space embeddings of POMDP where the feature of latent states and the feature of observations admit a conditional Hilbert space embedding of the observation emission process, and the latent state transition is deterministic. Under the function approximation setup where the optimal latent state-action $Q$-function is linear in the state feature, and the optimal $Q$-function has a gap in actions, we provide a \emph{computationally and statistically efficient} algorithm for finding the \emph{exact optimal} policy. We show our algorithm's computational and statistical complexities scale polynomially with respect to the horizon and the intrinsic dimension of the feature on the observation space. Furthermore, we show both the deterministic latent transitions and gap assumptions are necessary to avoid statistical complexity exponential in horizon or dimension. Since our guarantee does not have an explicit dependence on the size of the state and observation spaces, our algorithm provably scales to large-scale POMDPs.

Activation functions (AFs), which are pivotal to the success (or failure) of a neural network, have received increased attention in recent years, with researchers seeking to design novel AFs that improve some aspect of network performance. In this paper we take another direction, wherein we combine a slew of known AFs into successful architectures, proposing three methods to do so beneficially: 1) generate AF architectures at random, 2) use Optuna, an automatic hyper-parameter optimization software framework, with a Tree-structured Parzen Estimator (TPE) sampler, and 3) use Optuna with a Covariance Matrix Adaptation Evolution Strategy (CMA-ES) sampler. We show that all methods often produce significantly better results for 25 classification problems when compared with a standard network composed of ReLU hidden units and a softmax output unit. Optuna with the TPE sampler emerged as the best AF architecture-producing method.  ( 2 min )

We study Reinforcement Learning for partially observable dynamical systems using function approximation. We propose a new \textit{Partially Observable Bilinear Actor-Critic framework}, that is general enough to include models such as observable tabular Partially Observable Markov Decision Processes (POMDPs), observable Linear-Quadratic-Gaussian (LQG), Predictive State Representations (PSRs), as well as a newly introduced model Hilbert Space Embeddings of POMDPs and observable POMDPs with latent low-rank transition. Under this framework, we propose an actor-critic style algorithm that is capable of performing agnostic policy learning. Given a policy class that consists of memory based policies (that look at a fixed-length window of recent observations), and a value function class that consists of functions taking both memory and future observations as inputs, our algorithm learns to compete against the best memory-based policy in the given policy class. For certain examples such as undercomplete observable tabular POMDPs, observable LQGs and observable POMDPs with latent low-rank transition, by implicitly leveraging their special properties, our algorithm is even capable of competing against the globally optimal policy without paying an exponential dependence on the horizon in its sample complexity.  ( 2 min )

In recent years, the Thermal Image Super-Resolution (TISR) problem has become an attractive research topic. TISR would been used in a wide range of fields, including military, medical, agricultural and animal ecology. Due to the success of PBVS-2020 and PBVS-2021 workshop challenge, the result of TISR keeps improving and attracts more researchers to sign up for PBVS-2022 challenge. In this paper, we will introduce the technical details of our submission to PBVS-2022 challenge designing a Bilateral Network with Channel Splitting Network and Transformer(BN-CSNT) to tackle the TISR problem. Firstly, we designed a context branch based on channel splitting network with transformer to obtain sufficient context information. Secondly, we designed a spatial branch with shallow transformer to extract low level features which can preserve the spatial information. Finally, for the context branch in order to fuse the features from channel splitting network and transformer, we proposed an attention refinement module, and then features from context branch and spatial branch are fused by proposed feature fusion module. The proposed method can achieve PSNR=33.64, SSIM=0.9263 for x4 and PSNR=21.08, SSIM=0.7803 for x2 in the PBVS-2022 challenge test dataset.  ( 2 min )

A symmetry of a state $\lvert \psi \rangle$ is a unitary operator of which $\lvert \psi \rangle$ is an eigenvector. When $\lvert \psi \rangle$ is an unknown state supplied by a black-box oracle, the state's symmetries serve to characterize it, and often relegate much of the desired information about $\lvert \psi \rangle$. In this paper, we develop a variational hybrid quantum-classical learning scheme to systematically probe for symmetries of $\lvert \psi \rangle$ with no a priori assumptions about the state. This procedure can be used to learn various symmetries at the same time. In order to avoid re-learning already known symmetries, we introduce an interactive protocol with a classical deep neural net. The classical net thereby regularizes against repetitive findings and allows our algorithm to terminate empirically with all possible symmetries found. Our scheme can be implemented efficiently on average with non-local SWAP gates; we also give a less efficient algorithm with only local operations, which may be more appropriate for current noisy quantum devices. We demonstrate our algorithm on representative families of states.  ( 2 min )

Traffic signal control (TSC) is a high-stakes domain that is growing in importance as traffic volume grows globally. An increasing number of works are applying reinforcement learning (RL) to TSC; RL can draw on an abundance of traffic data to improve signalling efficiency. However, RL-based signal controllers have never been deployed. In this work, we provide the first review of challenges that must be addressed before RL can be deployed for TSC. We focus on four challenges involving (1) uncertainty in detection, (2) reliability of communications, (3) compliance and interpretability, and (4) heterogeneous road users. We show that the literature on RL-based TSC has made some progress towards addressing each challenge. However, more work should take a systems thinking approach that considers the impacts of other pipeline components on RL.  ( 2 min )

Proteins are essential component of human life and their structures are important for function and mechanism analysis. Recent work has shown the potential of AI-driven methods for protein structure prediction. However, the development of new models is restricted by the lack of dataset and benchmark training procedure. To the best of our knowledge, the existing open source datasets are far less to satisfy the needs of modern protein sequence-structure related research. To solve this problem, we present the first million-level protein structure prediction dataset with high coverage and diversity, named as PSP. This dataset consists of 570k true structure sequences (10TB) and 745k complementary distillation sequences (15TB). We provide in addition the benchmark training procedure for SOTA protein structure prediction model on this dataset. We validate the utility of this dataset for training by participating CAMEO contest in which our model won the first place. We hope our PSP dataset together with the training benchmark can enable a broader community of AI/biology researchers for AI-driven protein related research.

Methods for extracting audio and speech features have been studied since pioneering work on spectrum analysis decades ago. Recent efforts are guided by the ambition to develop general-purpose audio representations. For example, deep neural networks can extract optimal embeddings if they are trained on large audio datasets. This work extends existing methods based on self-supervised learning by bootstrapping, proposes various encoder architectures, and explores the effects of using different pre-training datasets. Lastly, we present a novel training framework to come up with a hybrid audio representation, which combines handcrafted and data-driven learned audio features. All the proposed representations were evaluated within the HEAR NeurIPS 2021 challenge for auditory scene classification and timestamp detection tasks. Our results indicate that the hybrid model with a convolutional transformer as the encoder yields superior performance in most HEAR challenge tasks.  ( 2 min )

The intersection of learning to rank and choice modeling is an active area of research with applications in e-commerce, information retrieval and the social sciences. In some applications such as recommendation systems, the statistician is primarily interested in recovering the set of the top ranked items from a large pool of items as efficiently as possible using passively collected discrete choice data, i.e., the user picks one item from a set of multiple items. Motivated by this practical consideration, we propose the choice-based Borda count algorithm as a fast and accurate ranking algorithm for top $K$-recovery i.e., correctly identifying all of the top $K$ items. We show that the choice-based Borda count algorithm has optimal sample complexity for top-$K$ recovery under a broad class of random utility models. We prove that in the limit, the choice-based Borda count algorithm produces the same top-$K$ estimate as the commonly used Maximum Likelihood Estimate method but the former's speed and simplicity brings considerable advantages in practice. Experiments on both synthetic and real datasets show that the counting algorithm is competitive with commonly used ranking algorithms in terms of accuracy while being several orders of magnitude faster.  ( 2 min )

Link prediction is a fundamental problem for graph-structured data (e.g., social networks, drug side-effect networks, etc.). Graph neural networks have offered robust solutions for this problem, specifically by learning the representation of the subgraph enclosing the target link (i.e., pair of nodes). However, these solutions do not scale well to large graphs as extraction and operation on enclosing subgraphs are computationally expensive, especially for large graphs. This paper presents a scalable link prediction solution, that we call ScaLed, which utilizes sparse enclosing subgraphs to make predictions. To extract sparse enclosing subgraphs, ScaLed takes multiple random walks from a target pair of nodes, then operates on the sampled enclosing subgraph induced by all visited nodes. By leveraging the smaller sampled enclosing subgraph, ScaLed can scale to larger graphs with much less overhead while maintaining high accuracy. ScaLed further provides the flexibility to control the trade-off between computation overhead and accuracy. Through comprehensive experiments, we have shown that ScaLed can produce comparable accuracy to those reported by the existing subgraph representation learning frameworks while being less computationally demanding.  ( 2 min )

Wasserstein distance, which measures the discrepancy between distributions, shows efficacy in various types of natural language processing (NLP) and computer vision (CV) applications. One of the challenges in estimating Wasserstein distance is that it is computationally expensive and does not scale well for many distribution comparison tasks. In this paper, we aim to approximate the 1-Wasserstein distance by the tree-Wasserstein distance (TWD), where TWD is a 1-Wasserstein distance with tree-based embedding and can be computed in linear time with respect to the number of nodes on a tree. More specifically, we propose a simple yet efficient L1-regularized approach to learning the weights of the edges in a tree. To this end, we first show that the 1-Wasserstein approximation problem can be formulated as a distance approximation problem using the shortest path distance on a tree. We then show that the shortest path distance can be represented by a linear model and can be formulated as a Lasso-based regression problem. Owing to the convex formulation, we can obtain a globally optimal solution efficiently. Moreover, we propose a tree-sliced variant of these methods. Through experiments, we demonstrated that the weighted TWD can accurately approximate the original 1-Wasserstein distance.  ( 2 min )

A major challenge in studying robustness in deep learning is defining the set of ``meaningless'' perturbations to which a given Neural Network (NN) should be invariant. Most work on robustness implicitly uses a human as the reference model to define such perturbations. Our work offers a new view on robustness by using another reference NN to define the set of perturbations a given NN should be invariant to, thus generalizing the reliance on a reference ``human NN'' to any NN. This makes measuring robustness equivalent to measuring the extent to which two NNs share invariances, for which we propose a measure called STIR. STIR re-purposes existing representation similarity measures to make them suitable for measuring shared invariances. Using our measure, we are able to gain insights into how shared invariances vary with changes in weight initialization, architecture, loss functions, and training dataset. Our implementation is available at: \url{https://github.com/nvedant07/STIR}.

Federated learning allows many devices to collaborate in the training of machine learning models. As in traditional machine learning, there is a growing concern that models trained with federated learning may exhibit disparate performance for different demographic groups. Existing solutions to measure and ensure equal model performance across groups require access to information about group membership, but this access is not always available or desirable, especially under the privacy aspirations of federated learning. We study the feasibility of measuring such performance disparities while protecting the privacy of the user's group membership and the federated model's performance on the user's data. Protecting both is essential for privacy, because they may be correlated, and thus learning one may reveal the other. On the other hand, from the utility perspective, the privacy-preserved data should maintain the correlation to ensure the ability to perform accurate measurements of the performance disparity. We achieve both of these goals by developing locally differentially private mechanisms that preserve the correlations between group membership and model performance. To analyze the effectiveness of the mechanisms, we bound their error in estimating the disparity when optimized for a given privacy budget, and validate these bounds on synthetic data. Our results show that the error rapidly decreases for realistic numbers of participating clients, demonstrating that, contrary to what prior work suggested, protecting the privacy of protected attributes is not necessarily in conflict with identifying disparities in the performance of federated models.

Node classification is of great importance among various graph mining tasks. In practice, real-world graphs generally follow the long-tail distribution, where a large number of classes only consist of limited labeled nodes. Although Graph Neural Networks (GNNs) have achieved significant improvements in node classification, their performance decreases substantially in such a few-shot scenario. The main reason can be attributed to the vast generalization gap between meta-training and meta-test due to the task variance caused by different node/class distributions in meta-tasks (i.e., node-level and class-level variance). Therefore, to effectively alleviate the impact of task variance, we propose a task-adaptive node classification framework under the few-shot learning setting. Specifically, we first accumulate meta-knowledge across classes with abundant labeled nodes. Then we transfer such knowledge to the classes with limited labeled nodes via our proposed task-adaptive modules. In particular, to accommodate the different node/class distributions among meta-tasks, we propose three essential modules to perform \emph{node-level}, \emph{class-level}, and \emph{task-level} adaptations in each meta-task, respectively. In this way, our framework can conduct adaptations to different meta-tasks and thus advance the model generalization performance on meta-test tasks. Extensive experiments on four prevalent node classification datasets demonstrate the superiority of our framework over the state-of-the-art baselines. Our code is provided at https://github.com/SongW-SW/TENT.

3D-related inductive biases like translational invariance and rotational equivariance are indispensable to graph neural networks operating on 3D atomistic graphs such as molecules. Inspired by the success of Transformers in various domains, we study how to incorporate these inductive biases into Transformers. In this paper, we present Equiformer, a graph neural network leveraging the strength of Transformer architectures and incorporating $SE(3)/E(3)$-equivariant features based on irreducible representations (irreps). Irreps features encode equivariant information in channel dimensions without complicating graph structures. The simplicity enables us to directly incorporate them by replacing original operations with equivariant counterparts. Moreover, to better adapt Transformers to 3D graphs, we propose a novel equivariant graph attention, which considers both content and geometric information such as relative position contained in irreps features. To improve expressivity of the attention, we replace dot product attention with multi-layer perceptron attention and include non-linear message passing. We benchmark Equiformer on two quantum properties prediction datasets, QM9 and OC20. For QM9, among models trained with the same data partition, Equiformer achieves best results on 11 out of 12 regression tasks. For OC20, under the setting of training with IS2RE data and optionally IS2RS data, Equiformer improves upon state-of-the-art models. Code reproducing all main results will be available soon.

Recent works in self-supervised learning have advanced the state-of-the-art by relying on the contrastive learning paradigm, which learns representations by pushing positive pairs, or similar examples from the same class, closer together while keeping negative pairs far apart. Despite the empirical successes, theoretical foundations are limited -- prior analyses assume conditional independence of the positive pairs given the same class label, but recent empirical applications use heavily correlated positive pairs (i.e., data augmentations of the same image). Our work analyzes contrastive learning without assuming conditional independence of positive pairs using a novel concept of the augmentation graph on data. Edges in this graph connect augmentations of the same data, and ground-truth classes naturally form connected sub-graphs. We propose a loss that performs spectral decomposition on the population augmentation graph and can be succinctly written as a contrastive learning objective on neural net representations. Minimizing this objective leads to features with provable accuracy guarantees under linear probe evaluation. By standard generalization bounds, these accuracy guarantees also hold when minimizing the training contrastive loss. Empirically, the features learned by our objective can match or outperform several strong baselines on benchmark vision datasets. In all, this work provides the first provable analysis for contrastive learning where guarantees for linear probe evaluation can apply to realistic empirical settings.

Differentiable architecture search (DARTS) is an effective method for data-driven neural network design based on solving a bilevel optimization problem. Despite its success in many architecture search tasks, there are still some concerns about the accuracy of first-order DARTS and the efficiency of the second-order DARTS. In this paper, we formulate a single level alternative and a relaxed architecture search (RARTS) method that utilizes the whole dataset in architecture learning via both data and network splitting, without involving mixed second derivatives of the corresponding loss functions like DARTS. In our formulation of network splitting, two networks with different but related weights cooperate in search of a shared architecture. The advantage of RARTS over DARTS is justified by a convergence theorem and an analytically solvable model. Moreover, RARTS outperforms DARTS and its variants in accuracy and search efficiency, as shown in adequate experimental results. For the task of searching topological architecture, i.e., the edges and the operations, RARTS obtains a higher accuracy and 60\% reduction of computational cost than second-order DARTS on CIFAR-10. RARTS continues to out-perform DARTS upon transfer to ImageNet and is on par with recent variants of DARTS even though our innovation is purely on the training algorithm without modifying search space. For the task of searching width, i.e., the number of channels in convolutional layers, RARTS also outperforms the traditional network pruning benchmarks. Further experiments on the public architecture search benchmark like NATS-Bench also support the preeminence of RARTS.  ( 3 min )

This paper studies the joint community detection and phase synchronization problem on the \textit{stochastic block model with relative phase}, where each node is associated with a phase. This problem, with a variety of real-world applications, aims to recover community memberships and associated phases simultaneously. By studying the maximum likelihood estimation formulation, we show that this problem exhibits a \textit{``multi-frequency''} structure. To this end, two simple yet efficient algorithms that leverage information across multiple frequencies are proposed. The former is a spectral method based on the novel multi-frequency column-pivoted QR factorization, and the latter is an iterative multi-frequency generalized power method. Numerical experiments indicate our proposed algorithms outperform state-of-the-art algorithms, in recovering community memberships and associated phases.  ( 2 min )

In statistical learning, many problem formulations have been proposed so far, such as multi-class learning, complementarily labeled learning, multi-label learning, multi-task learning, which provide theoretical models for various real-world tasks. Although they have been extensively studied, the relationship among them has not been fully investigated. In this work, we focus on a particular problem formulation called Multiple-Instance Learning (MIL), and show that various learning problems including all the problems mentioned above with some of new problems can be reduced to MIL with theoretically guaranteed generalization bounds, where the reductions are established under a new reduction scheme we provide as a by-product. The results imply that the MIL-reduction gives a simplified and unified framework for designing and analyzing algorithms for various learning problems. Moreover, we show that the MIL-reduction framework can be kernelized.  ( 2 min )

Rankings and scores are two common data types used by judges to express preferences and/or perceptions of quality in a collection of objects. Numerous models exist to study data of each type separately, but no unified statistical model captures both data types simultaneously without first performing data conversion. We propose the Mallows-Binomial model to close this gap, which combines a Mallows' $\phi$ ranking model with Binomial score models through shared parameters that quantify object quality, a consensus ranking, and the level of consensus between judges. We propose an efficient tree-search algorithm to calculate the exact MLE of model parameters, study statistical properties of the model both analytically and through simulation, and apply our model to real data from an instance of grant panel review that collected both scores and partial rankings. Furthermore, we demonstrate how model outputs can be used to rank objects with confidence. The proposed model is shown to sensibly combine information from both scores and rankings to quantify object quality and measure consensus with appropriate levels of statistical uncertainty.  ( 2 min )

Understanding capabilities and limitations of different network architectures is of fundamental importance to machine learning. Bayesian inference on Gaussian processes has proven to be a viable approach for studying recurrent and deep networks in the limit of infinite layer width, $n\to\infty$. Here we present a unified and systematic derivation of the mean-field theory for both architectures that starts from first principles by employing established methods from statistical physics of disordered systems. The theory elucidates that while the mean-field equations are different with regard to their temporal structure, they yet yield identical Gaussian kernels when readouts are taken at a single time point or layer, respectively. Bayesian inference applied to classification then predicts identical performance and capabilities for the two architectures. Numerically, we find that convergence towards the mean-field theory is typically slower for recurrent networks than for deep networks and the convergence speed depends non-trivially on the parameters of the weight prior as well as the depth or number of time steps, respectively. Our method exposes that Gaussian processes are but the lowest order of a systematic expansion in $1/n$ and we compute next-to-leading-order corrections which turn out to be architecture-specific. The formalism thus paves the way to investigate the fundamental differences between recurrent and deep architectures at finite widths $n$.  ( 3 min )

Self-attention, an architectural motif designed to model long-range interactions in sequential data, has driven numerous recent breakthroughs in natural language processing and beyond. This work provides a theoretical analysis of the inductive biases of self-attention modules. Our focus is to rigorously establish which functions and long-range dependencies self-attention blocks prefer to represent. Our main result shows that bounded-norm Transformer networks "create sparse variables": a single self-attention head can represent a sparse function of the input sequence, with sample complexity scaling only logarithmically with the context length. To support our analysis, we present synthetic experiments to probe the sample complexity of learning sparse Boolean functions with Transformers.  ( 2 min )

Most machine learning (ML) algorithms have several stochastic elements, and their performances are affected by these sources of randomness. This paper uses an empirical study to systematically examine the effects of two sources: randomness in model training and randomness in the partitioning of a dataset into training and test subsets. We quantify and compare the magnitude of the variation in predictive performance for the following ML algorithms: Random Forests (RFs), Gradient Boosting Machines (GBMs), and Feedforward Neural Networks (FFNNs). Among the different algorithms, randomness in model training causes larger variation for FFNNs compared to tree-based methods. This is to be expected as FFNNs have more stochastic elements that are part of their model initialization and training. We also found that random splitting of datasets leads to higher variation compared to the inherent randomness from model training. The variation from data splitting can be a major issue if the original dataset has considerable heterogeneity. Keywords: Model Training, Reproducibility, Variation  ( 2 min )

Data-driven approaches to modeling physical systems fail to generalize to unseen systems that share the same general dynamics with the learning domain, but correspond to different physical contexts. We propose a new framework for this key problem, context-informed dynamics adaptation (CoDA), which takes into account the distributional shift across systems for fast and efficient adaptation to new dynamics. CoDA leverages multiple environments, each associated to a different dynamic, and learns to condition the dynamics model on contextual parameters, specific to each environment. The conditioning is performed via a hypernetwork, learned jointly with a context vector from observed data. The proposed formulation constrains the search hypothesis space to foster fast adaptation and better generalization across environments. We theoretically motivate our approach and show state-of-the-art generalization results on a set of nonlinear dynamics, representative of a variety of application domains. We also show, on these systems, that new system parameters can be inferred from context vectors with minimal supervision. Code is available at https://github.com/yuan-yin/CoDA .  ( 2 min )